| SpectraBase Spectrum ID |
KKfguOMdJ6t |
| Name |
(-)-3-(o-Tolyl)-2,3-dihydrobenzo[b]thiophene 1,1-dioxide |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
258.071450863 u |
| Formula |
C15H14O2S |
| InChI |
InChI=1S/C15H14O2S/c1-11-6-2-3-7-12(11)14-10-18(16,17)15-9-5-4-8-13(14)15/h2-9,14H,10H2,1H3 |
| InChIKey |
CSQSQPNPOQVREL-UHFFFAOYSA-N |
| Instrument Name |
GCMSQP2010 SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201701409 |
| Optical Rotation |
[a]D20 = -44 (c = 0.63, CHCl3) |
| Quality |
218 |
| SMILES |
C1=CC2=C(C=C1)S(CC2C1=C(C=CC=C1)C)(=O)=O |
| SPLASH |
splash10-0a6u-2920000000-920b8639d0aec5997d92 |
| Sample Comments |
94% ee |
| Source of Spectrum |
ACI-56-SM17-2j (DOI: 10.1002/anie.201701409) |
| Wiley ID |
1895785 |
![(-)-3-(o-Tolyl)-2,3-dihydrobenzo[b]thiophene 1,1-dioxide](/api/spectrum/KKfguOMdJ6t/structure.png?h=300&w=458 "(-)-3-(o-Tolyl)-2,3-dihydrobenzo[b]thiophene 1,1-dioxide")
