| SpectraBase Spectrum ID |
LglE1qdxGcc |
| Name |
3-Benzylthio-3-(N-methyl-2-oxo-2,3-dihydro-benzoxazol-6-yl)-2-phenyl-prop-2-en-dithioic acid, benzyl ester |
| Comments |
isomer 1 |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C31H25NO2S3 |
| InChI |
InChI=1S/C31H25NO2S3/c1-32-26-18-17-25(19-27(26)34-31(32)33)29(36-20-22-11-5-2-6-12-22)28(24-15-9-4-10-16-24)30(35)37-21-23-13-7-3-8-14-23/h2-19H,20-21H2,1H3/b29-28- |
| InChIKey |
ATYFOHOLKJORIS-ZIADKAODSA-N |
| Instrument Name |
Bruker WP-80 |
| Literature Reference |
C. Vaccher, P. Berthelot, M. Debaert, Magn. Res. Chem. 27, 498 (1989). |
| NMR Standard |
TMS |
| Origin |
Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent |
CDCl3 |
