| SpectraBase Spectrum ID |
Kg1FTKurfOq |
| Name |
(+)-2-(p-Tolyl)-2,3-dihydrobenzo[b]thiophene 1,1-dioxide |
| Appearance |
Colorless crystalline solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
258.071450863 u |
| Formula |
C15H14O2S |
| InChI |
InChI=1S/C15H14O2S/c1-11-6-8-12(9-7-11)15-10-13-4-2-3-5-14(13)18(15,16)17/h2-9,15H,10H2,1H3 |
| InChIKey |
DQVMXQIFZXEURQ-UHFFFAOYSA-N |
| Instrument Name |
GCMSQP2010 SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201701409 |
| Optical Rotation |
[a]D20 = +73 (c 0.81, CHCl3) |
| Quality |
150 |
| SMILES |
C1=CC2=C(C=C1)S(C(C2)C1=CC=C(C=C1)C)(=O)=O |
| SPLASH |
splash10-004i-0910000000-bc18184d8a3e3b7bebb1 |
| Sample Comments |
98% ee |
| Source of Spectrum |
ACI-56-SM15-2b (DOI: 10.1002/anie.201701409) |
| Wiley ID |
1895777 |
![(+)-2-(p-Tolyl)-2,3-dihydrobenzo[b]thiophene 1,1-dioxide](/api/spectrum/Kg1FTKurfOq/structure.png?h=300&w=458 "(+)-2-(p-Tolyl)-2,3-dihydrobenzo[b]thiophene 1,1-dioxide")
