| SpectraBase Spectrum ID |
HsQA6d0sa3V |
| Name |
Benzene, 1-methoxy-4-[3-methyl-2-(phenylthio)-1-butenyl]-, (Z)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.123486437 u |
| Formula |
C18H20OS |
| InChI |
InChI=1S/C18H20OS/c1-14(2)18(20-17-7-5-4-6-8-17)13-15-9-11-16(19-3)12-10-15/h4-14H,1-3H3/b18-13- |
| InChIKey |
NZPQVMVSFBNNDK-AQTBWJFISA-N |
| SMILES |
C=1(\C=C\(SC=2C=CC=CC2)C(C)C)C=CC(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921068 |
![Benzene, 1-methoxy-4-[3-methyl-2-(phenylthio)-1-butenyl]-, (Z)-](/api/spectrum/HsQA6d0sa3V/structure.png?h=300&w=458 "Benzene, 1-methoxy-4-[3-methyl-2-(phenylthio)-1-butenyl]-, (Z)-")
