| SpectraBase Spectrum ID |
9d5C0QAZkIP |
| Name |
Benzene, 1,1'-[2-ethyl-1-(phenylthio)-2-hexene-1,6-diyl]bis-, (E)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
372.191172076 u |
| Formula |
C26H28S |
| InChI |
InChI=1S/C26H28S/c1-2-23(17-13-12-16-22-14-6-3-7-15-22)26(24-18-8-4-9-19-24)27-25-20-10-5-11-21-25/h3-11,14-15,17-21,26H,2,12-13,16H2,1H3/b23-17+ |
| InChIKey |
IOLANWASJBKEPE-HAVVHWLPSA-N |
| Molecular Weight |
372.570 g/mol |
| SMILES |
C(SC1=CC=CC=C1)(\C(=C\CCCC=1C=CC=CC1)CC)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923746 |
![Benzene, 1,1'-[2-ethyl-1-(phenylthio)-2-hexene-1,6-diyl]bis-, (E)-](/api/spectrum/9d5C0QAZkIP/structure.png?h=300&w=458 "Benzene, 1,1'-[2-ethyl-1-(phenylthio)-2-hexene-1,6-diyl]bis-, (E)-")
