| SpectraBase Spectrum ID |
BS5wSctgCaG |
| Name |
benzoic acid, 4-[[[(2Z)-tetrahydro-3-methyl-4-oxo-2-(phenylimino)-2H-1,3-thiazin-6-yl]carbonyl]amino]-, methyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.109627274 u |
| Formula |
C20H19N3O4S |
| InChI |
InChI=1S/C20H19N3O4S/c1-23-17(24)12-16(28-20(23)22-14-6-4-3-5-7-14)18(25)21-15-10-8-13(9-11-15)19(26)27-2/h3-11,16H,12H2,1-2H3,(H,21,25)/b22-20- |
| InChIKey |
MLHVQYMXHAOBFI-XDOYNYLZSA-N |
| Molecular Weight |
397.449 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_12873 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10222113; Lab Info: PE; Lab Number: PE-0002831 |
![benzoic acid, 4-[[[(2Z)-tetrahydro-3-methyl-4-oxo-2-(phenylimino)-2H-1,3-thiazin-6-yl]carbonyl]amino]-, methyl ester](/api/spectrum/BS5wSctgCaG/structure.png?h=300&w=458 "benzoic acid, 4-[[[(2Z)-tetrahydro-3-methyl-4-oxo-2-(phenylimino)-2H-1,3-thiazin-6-yl]carbonyl]amino]-, methyl ester")
