| SpectraBase Spectrum ID |
AXu3u0ZUi5q |
| Name |
benzoic acid, 2-[[[5-[[(4-nitrophenyl)methyl]thio]-1,3,4-thiadiazol-2-yl]amino]carbonyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
416.024911845 u |
| Formula |
C17H12N4O5S2 |
| InChI |
InChI=1S/C17H12N4O5S2/c22-14(12-3-1-2-4-13(12)15(23)24)18-16-19-20-17(28-16)27-9-10-5-7-11(8-6-10)21(25)26/h1-8H,9H2,(H,23,24)(H,18,19,22) |
| InChIKey |
YZFNWMZRAOCQDS-UHFFFAOYSA-N |
| Molecular Weight |
416.426 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8551 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10210200; Lab Info: LP; Lab Number: LP-0602054 |
![benzoic acid, 2-[[[5-[[(4-nitrophenyl)methyl]thio]-1,3,4-thiadiazol-2-yl]amino]carbonyl]-](/api/spectrum/AXu3u0ZUi5q/structure.png?h=300&w=458 "benzoic acid, 2-[[[5-[[(4-nitrophenyl)methyl]thio]-1,3,4-thiadiazol-2-yl]amino]carbonyl]-")
