| SpectraBase Spectrum ID |
HcYxopNJBHE |
| Name |
benzoic acid, 4-[[(2E)-3-[2-(1,2-dimethyl-1H-indol-3-yl)ethyl]tetrahydro-4-oxo-6-[(phenylamino)carbonyl]-2H-1,3-thiazin-2- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
568.214426696 u |
| Formula |
C32H32N4O4S |
| InChI |
InChI=1S/C32H32N4O4S/c1-4-40-31(39)22-14-16-24(17-15-22)34-32-36(19-18-25-21(2)35(3)27-13-9-8-12-26(25)27)29(37)20-28(41-32)30(38)33-23-10-6-5-7-11-23/h5-17,28H,4,18-20H2,1-3H3,(H,33,38)/b34-32+ |
| InChIKey |
CCAFLUPZFDCVRI-NWBJSICCSA-N |
| Molecular Weight |
568.692 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_16734 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11230445; Lab Info: PE; Lab Number: PE-0009404 |
![benzoic acid, 4-[[(2E)-3-[2-(1,2-dimethyl-1H-indol-3-yl)ethyl]tetrahydro-4-oxo-6-[(phenylamino)carbonyl]-2H-1,3-thiazin-2-](/api/spectrum/HcYxopNJBHE/structure.png?h=300&w=458 "benzoic acid, 4-[[(2E)-3-[2-(1,2-dimethyl-1H-indol-3-yl)ethyl]tetrahydro-4-oxo-6-[(phenylamino)carbonyl]-2H-1,3-thiazin-2-")
