SpectraBase Spectrum ID |
qCh1ZAhmsH |
Name |
1-Cyclohexyl-3H-benzo[d]isothiazole 1-oxide |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.103085344 u |
Formula |
C13H17NOS |
InChI |
InChI=1S/C13H17NOS/c15-16(12-7-2-1-3-8-12)13-9-5-4-6-11(13)10-14-16/h4-6,9,12H,1-3,7-8,10H2 |
InChIKey |
KALLUELHWYECIY-UHFFFAOYSA-N |
Instrument Name |
Finnigan SSQ 7000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201804284 |
Molecular Weight |
235.345 g/mol |
Reported Formula |
C13H17NOS |
SMILES |
C12=C(S(=NC2)(C2CCCCC2)=O)C=CC=C1 |
SPLASH |
splash10-000i-0920000000-7a552fefa7a15d11ffc9 |
Source of Spectrum |
ACI-57-SM18-4j (DOI: 10.1002/anie.201804284) |
Thin-Layer Chromatography |
0.52 (EtOAc/MeOH, 10:1) |
Wiley ID |
1893373 |