| SpectraBase Spectrum ID |
3g9ohq7dmS |
| Name |
1-Phenyl-3H-benzo[d]isothiazole 1-oxide |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
229.056135151 u |
| Formula |
C13H11NOS |
| InChI |
InChI=1S/C13H11NOS/c15-16(12-7-2-1-3-8-12)13-9-5-4-6-11(13)10-14-16/h1-9H,10H2 |
| InChIKey |
YISSYGNYBPNNML-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201804284 |
| Molecular Weight |
229.297 g/mol |
| Quality |
192 |
| Reported Formula |
C13H11NOS |
| SMILES |
C12=C(S(=NC2)(C=2C=CC=CC2)=O)C=CC=C1 |
| SPLASH |
splash10-01t9-6790000000-5f1e03eb96bbb95c1956 |
| Source of Spectrum |
ACI-57-SM18-4k (DOI: 10.1002/anie.201804284) |
| Thin-Layer Chromatography |
0.60 (EtOAc/MeOH, 10:1) |
| Wiley ID |
1893374 |
![1-Phenyl-3H-benzo[d]isothiazole 1-oxide](/api/spectrum/3g9ohq7dmS/structure.png?h=300&w=458 "1-Phenyl-3H-benzo[d]isothiazole 1-oxide")
