| SpectraBase Spectrum ID |
BlfQtfYkaQc |
| Name |
Benzene, 1,1'-[1,1-bis(phenylthio)-1,2-ethanediyl]bis- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.116293056 u |
| Formula |
C26H22S2 |
| InChI |
InChI=1S/C26H22S2/c1-5-13-22(14-6-1)21-26(23-15-7-2-8-16-23,27-24-17-9-3-10-18-24)28-25-19-11-4-12-20-25/h1-20H,21H2 |
| InChIKey |
QPWRXWCOKVQPGJ-UHFFFAOYSA-N |
| Molecular Weight |
398.582 g/mol |
| SMILES |
C(SC=1C=CC=CC1)(SC=1C=CC=CC1)(CC1=CC=CC=C1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962329 |
![Benzene, 1,1'-[1,1-bis(phenylthio)-1,2-ethanediyl]bis-](/api/spectrum/BlfQtfYkaQc/structure.png?h=300&w=458 "Benzene, 1,1'-[1,1-bis(phenylthio)-1,2-ethanediyl]bis-")
