SpectraBase Spectrum ID |
4YqkGUwNT03 |
Name |
benzoic acid, 4-[5-[[(2,4,6-trimethylphenyl)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 |
368.130697072 u |
Formula |
C19H20N4O2S |
InChI |
InChI=1S/C19H20N4O2S/c1-12-9-13(2)17(14(3)10-12)11-26-19-20-21-22-23(19)16-7-5-15(6-8-16)18(24)25-4/h5-10H,11H2,1-4H3 |
InChIKey |
REGLIJIGKVUJDF-UHFFFAOYSA-N |
Molecular Weight |
368.455 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_6571 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9273654; Lab Info: LP; Lab Number: LP-3701043 |