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(E)-4-(3',4'-Methylenedioxyphenyl)-1-(2-methylphenyl)but-1-ene

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(E)-4-(3',4'-Methylenedioxyphenyl)-1-(2-methylphenyl)but-1-ene
SpectraBase Compound ID ArZj2t29MSP
InChI InChI=1S/C18H18O2/c1-14-6-2-4-8-16(14)9-5-3-7-15-10-11-17-18(12-15)20-13-19-17/h2,4-6,8-12H,3,7,13H2,1H3/b9-5+
InChIKey GBZOZLDWZZZRAZ-WEVVVXLNSA-N
Mol Weight 266.34 g/mol
Molecular Formula C18H18O2
Exact Mass 266.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CJDMmjrb7OW
Name (E)-4-(3',4'-Methylenedioxyphenyl)-1-(2-methylphenyl)but-1-ene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 266.130679818 u
Formula C18H18O2
InChI InChI=1S/C18H18O2/c1-14-6-2-4-8-16(14)9-5-3-7-15-10-11-17-18(12-15)20-13-19-17/h2,4-6,8-12H,3,7,13H2,1H3/b9-5+
InChIKey GBZOZLDWZZZRAZ-WEVVVXLNSA-N
Molecular Weight 266.340 g/mol
SMILES C1=CC(CC\C=C\C2=C(C=CC=C2)C)=CC2=C1OCO2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.949762