| SpectraBase Spectrum ID |
4euXX8eQjiS |
| Name |
benzoic acid, 2-[[[5-[[2-[(4-fluorophenyl)amino]-2-oxoethyl]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 |
432.036225422 u |
| Formula |
C18H13FN4O4S2 |
| InChI |
InChI=1S/C18H13FN4O4S2/c19-10-5-7-11(8-6-10)20-14(24)9-28-18-23-22-17(29-18)21-15(25)12-3-1-2-4-13(12)16(26)27/h1-8H,9H2,(H,20,24)(H,26,27)(H,21,22,25) |
| InChIKey |
HCOPSYMBYCQABP-UHFFFAOYSA-N |
| Molecular Weight |
432.444 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8550 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10210199; Lab Info: LP; Lab Number: LP-0602053 |
![benzoic acid, 2-[[[5-[[2-[(4-fluorophenyl)amino]-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]amino]carbonyl]-](/api/spectrum/4euXX8eQjiS/structure.png?h=300&w=458 "benzoic acid, 2-[[[5-[[2-[(4-fluorophenyl)amino]-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]amino]carbonyl]-")
