SpectraBase Spectrum ID |
LBFhXfjaniX |
Name |
(E) and (Z)-1-Methoxy-2-methyl-5-phenyl-1-pentene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
190.135765199 u |
Formula |
C13H18O |
InChI |
InChI=1S/C13H18O/c1-12(11-14-2)7-6-10-13-8-4-3-5-9-13/h3-5,8-9,11H,6-7,10H2,1-2H3/b12-11+ |
InChIKey |
PVCDOFNRPLPWBZ-VAWYXSNFSA-N |
Molecular Weight |
190.286 g/mol |
SMILES |
CO\C=C\(CCCC=1C=CC=CC1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9302 |