| SpectraBase Spectrum ID |
8ozO9dMCGVd |
| Name |
[3-(Benzenesulfinyl)-3-(phenylthio)propyl]benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.095557611 u |
| Formula |
C21H20OS2 |
| InChI |
InChI=1S/C21H20OS2/c22-24(20-14-8-3-9-15-20)21(23-19-12-6-2-7-13-19)17-16-18-10-4-1-5-11-18/h1-15,21H,16-17H2 |
| InChIKey |
FDKLEIFLIXYUOD-UHFFFAOYSA-N |
| Molecular Weight |
352.510 g/mol |
| SMILES |
C(S(=O)C1=CC=CC=C1)(SC1=CC=CC=C1)CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895091 |
![[3-(Benzenesulfinyl)-3-(phenylthio)propyl]benzene](/api/spectrum/8ozO9dMCGVd/structure.png?h=300&w=458 "[3-(Benzenesulfinyl)-3-(phenylthio)propyl]benzene")
