| SpectraBase Spectrum ID |
CV79nwCZaiX |
| Name |
(Z)-4-Benzylidene-1-(3-chlorophenyl)-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 |
C16H12ClNO2S |
| InChI |
InChI=1S/C16H12ClNO2S/c17-14-7-4-8-15(10-14)21(20)11-13(16(19)18-21)9-12-5-2-1-3-6-12/h1-10H,11H2/b13-9+ |
| InChIKey |
BFSYEQFLNMIRDD-UKTHLTGXSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.orglett.1c03041 |
| Molecular Weight |
317.790 g/mol |
| Reported Formula |
C16H12NO2SCl |
| SMILES |
C1S(=NC(\C1=C/c1ccccc1)=O)(c1cc(ccc1)Cl)=O |
| SPLASH |
splash10-014i-0900000000-11061ea0a258635d3b57 |
| Source of Spectrum |
A1-23-SM13-2j |
| Wiley ID |
1868114 |
