SpectraBase Spectrum ID |
76uAFXpR53C |
Name |
2-(4-Methoxyphenyl)-2-(5-phenyl-4-pentenyl)-oxirane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
294.161979946 u |
Formula |
C20H22O2 |
InChI |
InChI=1S/C20H22O2/c1-21-19-13-11-18(12-14-19)20(16-22-20)15-7-3-6-10-17-8-4-2-5-9-17/h2,4-6,8-14H,3,7,15-16H2,1H3/b10-6+ |
InChIKey |
WVPUDHHFGJLSPH-UXBLZVDNSA-N |
SMILES |
C1(OC1)(CCC\C=C\C=1C=CC=CC1)C=1C=CC(=CC1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.830437 |