| SpectraBase Spectrum ID |
Kj2iLsVPJA9 |
| Name |
benzoic acid, 4-[[[(2E)-2-[(3,4-dimethylphenyl)imino]-3-methyl-4-oxothiazolidinyl]acetyl]amino]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
411.125277338 u |
| Formula |
C21H21N3O4S |
| InChI |
InChI=1S/C21H21N3O4S/c1-12-4-7-16(10-13(12)2)23-21-24(3)19(26)17(29-21)11-18(25)22-15-8-5-14(6-9-15)20(27)28/h4-10,17H,11H2,1-3H3,(H,22,25)(H,27,28)/b23-21+ |
| InChIKey |
NTGRRDGHAHXCOW-XTQSDGFTSA-N |
| Molecular Weight |
411.476 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_15 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8048932; Lab Info: LD; Lab Number: LD-1400070 |
| Temperature |
29.85 °C |
![benzoic acid, 4-[[[(2E)-2-[(3,4-dimethylphenyl)imino]-3-methyl-4-oxothiazolidinyl]acetyl]amino]-](/api/spectrum/Kj2iLsVPJA9/structure.png?h=300&w=458 "benzoic acid, 4-[[[(2E)-2-[(3,4-dimethylphenyl)imino]-3-methyl-4-oxothiazolidinyl]acetyl]amino]-")
