| SpectraBase Spectrum ID |
cVgY3irJ2 |
| Name |
(Z)-4-(4-Methylbenzylidene)-1-phenyl-4,5-dihydro-3H-1.lambda.6-isothiazol-3-one-1-oxide |
| Appearance |
Pink oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H15NO2S |
| InChI |
InChI=1S/C17H15NO2S/c1-13-7-9-14(10-8-13)11-15-12-21(20,18-17(15)19)16-5-3-2-4-6-16/h2-11H,12H2,1H3/b15-11+ |
| InChIKey |
NBFGPBUNLJIOGO-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/c1ccc(cc1)C)=O)(c1ccccc1)=O |
| SPLASH |
splash10-00l2-0940000000-12dc8b70ce59efaa8153 |
| Source of Spectrum |
A1-23-SM16-2q |
| Wiley ID |
1868121 |
