| SpectraBase Spectrum ID |
2i38DUVRQyO |
| Name |
1-(p-Tolyl)-4,5-dihydro-3H-isothiazole 1-oxide |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
195.071785216 u |
| Formula |
C10H13NOS |
| InChI |
InChI=1S/C10H13NOS/c1-9-3-5-10(6-4-9)13(12)8-2-7-11-13/h3-6H,2,7-8H2,1H3 |
| InChIKey |
YQKPQOPYIYSGKO-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201804284 |
| Molecular Weight |
195.280 g/mol |
| Quality |
99 |
| Reported Formula |
C10H13NOS |
| SMILES |
C1(=CC=C(C=C1)C)S1(=NCCC1)=O |
| SPLASH |
splash10-000i-5900000000-bb9ae13202655c45b1a6 |
| Source of Spectrum |
ACI-57-SM13-2b (DOI: 10.1002/anie.201804284) |
| Thin-Layer Chromatography |
0.43 (EtOAc/MeOH, 10:1) |
| Wiley ID |
1893335 |
