| SpectraBase Spectrum ID |
8JifFvieFdq |
| Name |
benzoic acid, 4-[[[4-phenyl-5-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]methyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
401.119798036 u |
| Formula |
C23H19N3O2S |
| InChI |
InChI=1S/C23H19N3O2S/c27-22(28)19-13-11-18(12-14-19)16-29-23-25-24-21(15-17-7-3-1-4-8-17)26(23)20-9-5-2-6-10-20/h1-14H,15-16H2,(H,27,28) |
| InChIKey |
SJGACKHVCUMHHR-UHFFFAOYSA-N |
| Molecular Weight |
401.484 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_14089 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10300454; Lab Info: LP; Lab Number: LP-2190430 |
![benzoic acid, 4-[[[4-phenyl-5-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-](/api/spectrum/8JifFvieFdq/structure.png?h=300&w=458 "benzoic acid, 4-[[[4-phenyl-5-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-")
