| SpectraBase Spectrum ID |
JSvjsEyykmV |
| Name |
benzoic acid, 4-[[[(2E)-3-(1,3-benzodioxol-5-ylmethyl)tetrahydro-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 |
517.130756641 u |
| Formula |
C27H23N3O6S |
| InChI |
InChI=1S/C27H23N3O6S/c1-34-26(33)18-8-10-20(11-9-18)28-25(32)23-14-24(31)30(27(37-23)29-19-5-3-2-4-6-19)15-17-7-12-21-22(13-17)36-16-35-21/h2-13,23H,14-16H2,1H3,(H,28,32)/b29-27+ |
| InChIKey |
SOUFJIBGWQLMNJ-ORIPQNMZSA-N |
| Molecular Weight |
517.556 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_14256 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10222084; Lab Info: PE; Lab Number: PE-0002710 |
![benzoic acid, 4-[[[(2E)-3-(1,3-benzodioxol-5-ylmethyl)tetrahydro-4-oxo-2-(phenylimino)-2H-1,3-thiazin-6-yl]carbonyl]amino]-, methyl ester](/api/spectrum/JSvjsEyykmV/structure.png?h=300&w=458 "benzoic acid, 4-[[[(2E)-3-(1,3-benzodioxol-5-ylmethyl)tetrahydro-4-oxo-2-(phenylimino)-2H-1,3-thiazin-6-yl]carbonyl]amino]-, methyl ester")
