SpectraBase Spectrum ID |
Kq33dRave6Q |
Name |
(Z)-1-Methyl-2-(3-methyl-1-phenylbut-1-enyl)benzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
236.156500644 u |
Formula |
C18H20 |
InChI |
InChI=1S/C18H20/c1-14(2)13-18(16-10-5-4-6-11-16)17-12-8-7-9-15(17)3/h4-14H,1-3H3/b18-13- |
InChIKey |
SUGLWCNXSXQOBZ-AQTBWJFISA-N |
Molecular Weight |
236.358 g/mol |
SMILES |
C=1C=C(C=CC1)\C(=C\C(C)C)C1=C(C=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974058 |