| SpectraBase Spectrum ID |
2BmlpSRH4Ms |
| Name |
(Z)-4-(3-Methylbenzylidene)-1-phenyl-4,5-dihydro-3H-1.lambda.6-isothiazol-3-one-1-oxide |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H15NO2S |
| InChI |
InChI=1S/C17H15NO2S/c1-13-6-5-7-14(10-13)11-15-12-21(20,18-17(15)19)16-8-3-2-4-9-16/h2-11H,12H2,1H3/b15-11+ |
| InChIKey |
CHRVSGFYWJHVQN-RVDMUPIBSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.orglett.1c03041 |
| Molecular Weight |
297.372 g/mol |
| Reported Formula |
C17H15NO2S |
| SMILES |
C1S(=NC(\C1=C/c1cccc(c1)C)=O)(c1ccccc1)=O |
| SPLASH |
splash10-0a4j-9600000000-dfda4b93f6c3a4c316be |
| Source of Spectrum |
A1-23-SM19-2w |
| Wiley ID |
1868126 |
