SpectraBase Spectrum ID |
71mmuaRovJU |
Name |
3-piperidinecarboxylic acid, 1-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfonyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
339.100125217 u |
Formula |
C13H17N5O4S |
InChI |
InChI=1S/C13H17N5O4S/c1-8-6-9(2)18-12(14-8)15-13(16-18)23(21,22)17-5-3-4-10(7-17)11(19)20/h6,10H,3-5,7H2,1-2H3,(H,19,20) |
InChIKey |
VKFOWTKJYXNMTC-UHFFFAOYSA-N |
Molecular Weight |
339.370 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14160 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10310340; Lab Info: VUR; Lab Number: VUR-0002131 |