| SpectraBase Spectrum ID |
2cC630hd08u |
| Name |
benzoic acid, 2-[[[2-[[2-[(4-acetylphenyl)amino]-2-oxoethyl]thio]-6-benzothiazolyl]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 |
505.076613067 u |
| Formula |
C25H19N3O5S2 |
| InChI |
InChI=1S/C25H19N3O5S2/c1-14(29)15-6-8-16(9-7-15)26-22(30)13-34-25-28-20-11-10-17(12-21(20)35-25)27-23(31)18-4-2-3-5-19(18)24(32)33/h2-12H,13H2,1H3,(H,26,30)(H,27,31)(H,32,33) |
| InChIKey |
CNGVFIOHCRDNIX-UHFFFAOYSA-N |
| Molecular Weight |
505.563 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_9156 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9296420; Lab Info: LP; Lab Number: LP-0609110 |
![benzoic acid, 2-[[[2-[[2-[(4-acetylphenyl)amino]-2-oxoethyl]thio]-6-benzothiazolyl]amino]carbonyl]-](/api/spectrum/2cC630hd08u/structure.png?h=300&w=458 "benzoic acid, 2-[[[2-[[2-[(4-acetylphenyl)amino]-2-oxoethyl]thio]-6-benzothiazolyl]amino]carbonyl]-")
