Difference: TempCalib (1 vs. 31)

Revision 3102 Dec 2014 - Main.ShibaniBhattacharya

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
  • The equations obtained from temperature calibration using a thermocouple are reported in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 1.7 mm probe in 800us2#2, the calibration curve was generated using 99.5% methanol-d4)
Changed:
<
<
Instrument(s) Neat 1H Methanol 99.5% Methanol-d4 THERMOCOUPLE
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406 Y = 0.963X + 7.175
900#2 n.a. Y = 0.9528X + 6.6471 Y = 0.994X - 5.96
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617X + 7.6482 Y = 0.9697X + 5.3222
800US#2 Y = 0.9343X + 13.9249 (5mm) Y = 0.9714X + 4.9008 (5 mm) Y = 0.9535X + 11.098 (1.7 mm)
800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15 Y = 0.9604X + 8.0771
>
>
Instrument(s) Neat 1H Methanol 99.5% Methanol-d4 THERMOCOUPLE PROBE ID Last Updated
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406 Y = 0.963X + 7.175 Z44910/0008 11/05/13
900#2 n.a. Y = 0.9528X + 6.6471 Y = 0.994X - 5.96 Z44910/0005 08/20/13
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617X + 7.6482 Y = 0.9697X + 5.3222 Z44909/021 02/16/11
800US#2 Y = 0.9343X + 13.9249 (5mm) Y = 0.9714X + 4.9008 (5 mm) Y = 0.9535X + 11.098 (1.7 mm) Z110385/001 03/07/13
800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15 Y = 0.9604X + 8.0771 Z44918/0025 02/14/11
 
700 Y = 0.9334X + 13.3864 Y = 0.9714X + 5.4524 n.a.
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467 n.a.
Changed:
<
<
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511 Y = 0.9643X + 7.575
>
>
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511 Y = 0.9643X + 7.575 Z44861/0042 09/30/14
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 3001 Dec 2014 - Main.ShibaniBhattacharya

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Changed:
<
<
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
Instrument(s) OLD Calibration Equation Neat 1H Methanol NEW CALIBRATION EQUATION 99.5% Methanol-d4
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406
900#2 n.a. Y = 0.9528X + 6.6471
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617X + 7.6482
800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008
800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15
700 Y = 0.9334X + 13.3864 Y = 0.9714X + 5.4524
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511
>
>
  • The equations obtained from temperature calibration using a thermocouple are reported in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 1.7 mm probe in 800us2#2, the calibration curve was generated using 99.5% methanol-d4)
Instrument(s) Neat 1H Methanol 99.5% Methanol-d4 THERMOCOUPLE
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406 Y = 0.963X + 7.175
900#2 n.a. Y = 0.9528X + 6.6471 Y = 0.994X - 5.96
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617X + 7.6482 Y = 0.9697X + 5.3222
800US#2 Y = 0.9343X + 13.9249 (5mm) Y = 0.9714X + 4.9008 (5 mm) Y = 0.9535X + 11.098 (1.7 mm)
800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15 Y = 0.9604X + 8.0771
700 Y = 0.9334X + 13.3864 Y = 0.9714X + 5.4524 n.a.
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467 n.a.
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511 Y = 0.9643X + 7.575
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2909 Jul 2007 - Main.KaushikDutta

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
Instrument(s) OLD Calibration Equation Neat 1H Methanol NEW CALIBRATION EQUATION 99.5% Methanol-d4
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406
900#2 n.a. Y = 0.9528X + 6.6471
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617X + 7.6482
800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008
800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15
Changed:
<
<
700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553
>
>
700 Y = 0.9334X + 13.3864 Y = 0.9714X + 5.4524
 
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2809 Jul 2007 - Main.DavidCowburn

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
Instrument(s) OLD Calibration Equation Neat 1H Methanol NEW CALIBRATION EQUATION 99.5% Methanol-d4
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406
900#2 n.a. Y = 0.9528X + 6.6471
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617X + 7.6482
800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008
800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15
700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511
Changed:
<
<
>
>
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2705 Jul 2007 - Main.KaushikDutta

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Changed:
<
<
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4) Instrument OLD Calibration
    Equation Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406 900#2 n.a. Y = 0.9528X + 6.6471 800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482 800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008 800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15
    700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553 600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467 500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511
>
>
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
Added:
>
>
Instrument(s) OLD Calibration Equation Neat 1H Methanol NEW CALIBRATION EQUATION 99.5% Methanol-d4
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406
900#2 n.a. Y = 0.9528X + 6.6471
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617X + 7.6482
800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008
800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15
700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

Added:
>
>
 
META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2605 Jul 2007 - Main.KaushikDutta

 
META TOPICPARENT name="NmrStaffnotes"
Changed:
<
<

New NMR Temperature Calibration Protocol and Correction of old calibration sets

>
>

New NMR Temperature Calibration Protocol and Correction of old calibration sets

 
  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Changed:
<
<
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)InstrumentOLD Calibration
    Equation Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406 900#2 n.a. Y = 0.9528X + 6.6471 800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482 800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008 800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15
    700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553 600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467 500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511
>
>
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4) Instrument OLD Calibration
    Equation Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406 900#2 n.a. Y = 0.9528X + 6.6471 800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482 800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008 800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15
    700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553 600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467 500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2505 Jul 2007 - Main.KaushikDutta

 
META TOPICPARENT name="NmrStaffnotes"
Changed:
<
<

New NMR Temperature Calibration Protocol and Correction of old calibration sets

>
>

New NMR Temperature Calibration Protocol and Correction of old calibration sets

 
  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Changed:
<
<
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
>
>
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)InstrumentOLD Calibration
    Equation Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406 900#2 n.a. Y = 0.9528X + 6.6471 800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482 800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008 800conv Y = 0.9590X + 7.3346 Y = 0.9784X + 3.15
    700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553 600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467 500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511
Deleted:
<
<
Instrument OLD Calibration
Equation Neat 1H Methanol
NEW CALIBRATION EQUATION
99.5% Methanol-d4
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406
900#2 n.a. Y = 0.9528X + 6.6471
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482
800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008
800conv Y = 0.9590X + 7.3346 not yet generated.
700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511
 
Deleted:
<
<
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

Deleted:
<
<
 
META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2425 Jun 2007 - Main.DavidCowburn

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
Instrument OLD Calibration
Equation Neat 1H Methanol
NEW CALIBRATION EQUATION
99.5% Methanol-d4
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406
Changed:
<
<
900#2   Y = 0.9528X + 6.6471
>
>
900#2 n.a. Y = 0.9528X + 6.6471
 
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482
800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008
800conv Y = 0.9590X + 7.3346 not yet generated.
700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2325 Jun 2007 - Main.DavidCowburn

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
Instrument OLD Calibration
Equation Neat 1H Methanol
NEW CALIBRATION EQUATION
99.5% Methanol-d4
Changed:
<
<
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406
>
>
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406
 
900#2   Y = 0.9528X + 6.6471
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482
800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008
800conv Y = 0.9590X + 7.3346 not yet generated.
700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2225 Jun 2007 - Main.MichaelGoger

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Changed:
<
<
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
    InstrumentOLD Calibration Equation
    Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406 900#2 Y = 0.9528X + 6.6471 800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482 800US#2
    Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008 800conv Y = 0.9590X + 7.3346 not yet generated.700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553 600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467 500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511


>
>
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
Added:
>
>
Instrument OLD Calibration
Equation Neat 1H Methanol
NEW CALIBRATION EQUATION
99.5% Methanol-d4
900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406
900#2   Y = 0.9528X + 6.6471
800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482
800US#2 Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008
800conv Y = 0.9590X + 7.3346 not yet generated.
700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553
600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467
500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511
 
Added:
>
>
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

Added:
>
>
 
META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2125 Jun 2007 - Main.MichaelGoger

 
META TOPICPARENT name="NmrStaffnotes"
Changed:
<
<

New NMR Temperature Calibration Protocol and Correction of old calibration sets

>
>

New NMR Temperature Calibration Protocol and Correction of old calibration sets

 
  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Changed:
<
<
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using
>
>
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% methanol-d4)
    InstrumentOLD Calibration Equation
    Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492 Y = 0.978X + 2.406 900#2 Y = 0.9528X + 6.6471 800US#1 Y = 0.9817X - 0.3126 Y = 0.9617 X + 7.6482 800US#2
    Y = 0.9343X + 13.9249 Y = 0.9714X + 4.9008 800conv Y = 0.9590X + 7.3346 not yet generated.700 Y = 0.9334X + 13.3864 Y = 0.9413X + 9.8553 600 Y = 0.9956X - 3.058 Y = 0.9588X + 9.467 500 Y = 0.9116X + 27.563 Y = 0.9984X + 2.9511


Deleted:
<
<


  • Instrument
    OLD Calibration Equation
    Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492
    Y = 0.978X + 2.406
    900#2 %SPAN% Y = 0.9528X + 6.6471
    800US#1 Y = 0.9817X - 0.3126
    Y = 0.9617 X + 7.6482
    800US#2 Y = 0.9343X + 13.9249
    Y = 0.9714X + 4.9008
    800conv Y = 0.9590X + 7.3346
    not yet generated.
    700 Y = 0.9334X + 13.3864
    Y = 0.9413X + 9.8553
    600 Y = 0.9956X - 3.058
    Y = 0.9588X + 9.467
    500
    Y = 0.9116X + 27.563
    Y = 0.9984X + 2.9511
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 2025 Jun 2007 - Main.MichaelGoger

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Changed:
<
<
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5%methanol-d4
    Instrument
    OLD Calibration Equation
    Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492
    Y = 0.978X + 2.406
    900#2 %SPAN% Y = 0.9528X + 6.6471
    800US#1 Y = 0.9817X - 0.3126
    Y = 0.9617 X + 7.6482
    800US#2 Y = 0.9343X + 13.9249
    Y = 0.9714X + 4.9008
    800conv Y = 0.9590X + 7.3346
    not yet generated.
    700 Y = 0.9334X + 13.3864
    Y = 0.9413X + 9.8553
    600 Y = 0.9956X - 3.058
    Y = 0.9588X + 9.467
    500
    Y = 0.9116X + 27.563
    Y = 0.9984X + 2.9511
>
>
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using
Added:
>
>


  • Instrument
    OLD Calibration Equation
    Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492
    Y = 0.978X + 2.406
    900#2 %SPAN% Y = 0.9528X + 6.6471
    800US#1 Y = 0.9817X - 0.3126
    Y = 0.9617 X + 7.6482
    800US#2 Y = 0.9343X + 13.9249
    Y = 0.9714X + 4.9008
    800conv Y = 0.9590X + 7.3346
    not yet generated.
    700 Y = 0.9334X + 13.3864
    Y = 0.9413X + 9.8553
    600 Y = 0.9956X - 3.058
    Y = 0.9588X + 9.467
    500
    Y = 0.9116X + 27.563
    Y = 0.9984X + 2.9511
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 1925 Jun 2007 - Main.MichaelGoger

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Changed:
<
<
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% Methanol?-d4)
    Instrument
    OLD Calibration Equation
    Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492
    Y = 0.978X + 2.406
    900#2 %SPAN% Y = 0.9528X + 6.6471
    800US#1 Y = 0.9817X - 0.3126
    Y = 0.9617 X + 7.6482
    800US#2 Y = 0.9343X + 13.9249
    Y = 0.9714X + 4.9008
    800conv Y = 0.9590X + 7.3346
    not yet generated.
    700 Y = 0.9334X + 13.3864
    Y = 0.9413X + 9.8553
    600 Y = 0.9956X - 3.058
    Y = 0.9588X + 9.467
    500
    Y = 0.9116X + 27.563
    Y = 0.9984X + 2.9511
>
>
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5%methanol-d4
    Instrument
    OLD Calibration Equation
    Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492
    Y = 0.978X + 2.406
    900#2 %SPAN% Y = 0.9528X + 6.6471
    800US#1 Y = 0.9817X - 0.3126
    Y = 0.9617 X + 7.6482
    800US#2 Y = 0.9343X + 13.9249
    Y = 0.9714X + 4.9008
    800conv Y = 0.9590X + 7.3346
    not yet generated.
    700 Y = 0.9334X + 13.3864
    Y = 0.9413X + 9.8553
    600 Y = 0.9956X - 3.058
    Y = 0.9588X + 9.467
    500
    Y = 0.9116X + 27.563
    Y = 0.9984X + 2.9511
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 1825 Jun 2007 - Main.MichaelGoger

 
META TOPICPARENT name="NmrStaffnotes"
Changed:
<
<

New NMR Temperature Calibration Protocol and Correction of old calibration sets

>
>

New NMR Temperature Calibration Protocol and Correction of old calibration sets

 
  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Changed:
<
<
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% MeOH?-d4)
>
>
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% Methanol?-d4)
    Instrument
    OLD Calibration Equation
    Neat 1H Methanol
    NEW CALIBRATION EQUATION
    99.5% Methanol-d4
    900#1 Y = 0.9267X + 17.492
    Y = 0.978X + 2.406
    900#2 %SPAN% Y = 0.9528X + 6.6471
    800US#1 Y = 0.9817X - 0.3126
    Y = 0.9617 X + 7.6482
    800US#2 Y = 0.9343X + 13.9249
    Y = 0.9714X + 4.9008
    800conv Y = 0.9590X + 7.3346
    not yet generated.
    700 Y = 0.9334X + 13.3864
    Y = 0.9413X + 9.8553
    600 Y = 0.9956X - 3.058
    Y = 0.9588X + 9.467
    500
    Y = 0.9116X + 27.563
    Y = 0.9984X + 2.9511
Deleted:
<
<
Instrument
OLD Calibration Equation
Neat 1H Methanol
NEW CALIBRATION EQUATION
99.5% Methanol-d4
900#1 Y = 0.9267X + 17.492
Y = 0.978X + 2.406
900#2 Y = 0.9528X + 6.6471
800US#1 Y = 0.9817X - 0.3126
Y = 0.9617 X + 7.6482
800US#2 Y = 0.9343X + 13.9249
Y = 0.9714X + 4.9008
800conv Y = 0.9590X + 7.3346
not yet generated.
700 Y = 0.9334X + 13.3864
Y = 0.9413X + 9.8553
600 Y = 0.9956X - 3.058
Y = 0.9588X + 9.467
500
Y = 0.9116X + 27.563
Y = 0.9984X + 2.9511
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 1725 Jun 2007 - Main.MichaelGoger

 
META TOPICPARENT name="NmrStaffnotes"
Changed:
<
<

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
>
>

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
 
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
Changed:
<
<
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
>
>
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Added:
>
>
  • The equations in the table below are the same ones posted in the red log book at each spectrometer. In each equation Y=sample temp, X=EDTE temp set point. (NOTE: for 900#2, orginal calibration curve was generated using 99.5% MeOH?-d4)
Instrument
OLD Calibration Equation
Neat 1H Methanol
NEW CALIBRATION EQUATION
99.5% Methanol-d4
up
500
Y = 0.9116X + 27.563
Y = 0.9984X + 2.9511
900#1 Y = 0.9267X + 17.492
Y = 0.978X + 2.406
800US#2 Y = 0.9343X + 13.9249
Y = 0.9714X + 4.9008
800US#1 Y = 0.9817X - 0.3126
Y = 0.9617 X + 7.6482
600 Y = 0.9956X - 3.058
Y = 0.9588X + 9.467
900#2 Y = 0.9528X + 6.6471
700 Y = 0.9334X + 13.3864
Y = 0.9413X + 9.8553
800conv Y = 0.9590X + 7.3346
not yet generated.
 

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

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META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 1620 Jun 2007 - Main.DavidCowburn

 
META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.
Added:
>
>
 -- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

Revision 1520 Jun 2007 - Main.DavidCowburn

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META TOPICPARENT name="NmrStaffnotes"

New NMR Temperature Calibration Protocol and Correction of old calibration sets

  • Based on Findeisen et al. (Magn. Reson. Chem. 2007; 45: 175–178 findeisen2006.pdf), we determined that the temperature calibration curves generated using neat methanol, in use prior to June 2007, have resulted in a systematic error in sample temperatures of about +2-3 deg, i.e. actual sample temperatures were about 2-3 degrees warmer than indicated from the calibration. You may wish to record and report this specifically for the data sets prior to June 2007.
  • We have since generated new calibration curves, starting in June 2007, for each spectrometer, using 99.5% methanol-d4, as suggested by Findeisen et al. We have also confirmed using a thermocouple that the new calibration curves do provide accurate temperatures.
  • Both sets of calibration curves will remain in the red log books at each spectrometer. This will allow you to correct your temperatures appropriately. We recommend that you use the new calibrations. The old calibration curves will be removed sometime in the next six months. We suggest you record which calibration curve you use.
  • As an example, for 800US2#1, if your desired sample temp was 298K, using the old calibration curve you would have set the controller target temp in edte as 303.87K, but your temperature would actually have been c. 300 deg K. The new calibration curve shows that for a controller target temp in edte of 303.87K, your actual sample temp would have been 299.87K.
  • For 800US2#1, using the new calibration curve to achieve an actual sample temp of 298K, you would now need to set the controller target temp in edte as 301.92. However, if you wish to match the older sample temp of 299.87K, in the example above, you would just set the controller target temp in edte as 303.87.

-- MichaelGoger - 20 Jun 2007 * findeisen2006.pdf: findeisen2006.pdf

META FILEATTACHMENT attachment="findeisen2006.pdf" attr="" comment="" date="1182361284" name="findeisen2006.pdf" path="findeisen2006.pdf" size="177874" stream="findeisen2006.pdf" user="Main.MichaelGoger" version="1"

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