| SpectraBase Spectrum ID |
BJzlRaGxVwE |
| Name |
(Z)-4-(3-Fluorobenzylidene)-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 |
C16H12FNO2S |
| InChI |
InChI=1S/C16H12FNO2S/c17-14-6-4-5-12(10-14)9-13-11-21(20,18-16(13)19)15-7-2-1-3-8-15/h1-10H,11H2/b13-9+ |
| InChIKey |
NSXXWDBUVMJLEY-UKTHLTGXSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.orglett.1c03041 |
| Molecular Weight |
301.335 g/mol |
| Reported Formula |
C16H12NO2SF |
| SMILES |
C1S(=NC(\C1=C/c1cccc(c1)F)=O)(c1ccccc1)=O |
| SPLASH |
splash10-001i-0903000000-0e6bb4bab6bbc794f274 |
| Source of Spectrum |
A1-23-SM20-2x |
| Wiley ID |
1868127 |
