| SpectraBase Spectrum ID |
1O7IJZ1e2ft |
| Name |
5-Methyl-1-phenyl-4,5-dihydro-3H-isothiazole 1-oxide |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
195.071785216 u |
| Formula |
C10H13NOS |
| InChI |
InChI=1S/C10H13NOS/c1-9-7-8-11-13(9,12)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3 |
| InChIKey |
KEGJEXCRAHRFPK-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201804284 |
| Molecular Weight |
195.280 g/mol |
| Reported Formula |
C10H13NOS |
| SMILES |
CC1CCN=S1(C1=CC=CC=C1)=O |
| SPLASH |
splash10-002e-0900000000-bb74d30654be7c9b3037 |
| Sample Comments |
dr = 1:1 |
| Source of Spectrum |
ACI-57-SM15-2o (DOI: 10.1002/anie.201804284) |
| Thin-Layer Chromatography |
0.55 (EtOAc/MeOH, 10:1) |
| Wiley ID |
1893346 |
