SpectraBase Spectrum ID |
3YvTUSGUkLj |
Name |
benzoic acid, 4-[5-[[(2-methylphenyl)methyl]thio]-1H-tetrazol-1-yl]-,methyl ester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
340.099396943 u |
Formula |
C17H16N4O2S |
InChI |
InChI=1S/C17H16N4O2S/c1-12-5-3-4-6-14(12)11-24-17-18-19-20-21(17)15-9-7-13(8-10-15)16(22)23-2/h3-10H,11H2,1-2H3 |
InChIKey |
URQJMMIHWAECHR-UHFFFAOYSA-N |
Molecular Weight |
340.401 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_6573 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9273658; Lab Info: LP; Lab Number: LP-3701047 |