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1-Methyl-4-(1,2,2-triphenylethenyl)benzene

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

1-Methyl-4-(1,2,2-triphenylethenyl)benzene
SpectraBase Compound ID 3bgZBWDMBP6
InChI InChI=1S/C27H22/c1-21-17-19-25(20-18-21)27(24-15-9-4-10-16-24)26(22-11-5-2-6-12-22)23-13-7-3-8-14-23/h2-20H,1H3
InChIKey CNZZQDOFHHSVMJ-UHFFFAOYSA-N
Mol Weight 346.47 g/mol
Molecular Formula C27H22
Exact Mass 346.172151 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DRdlDFEnfpO
Name 1-Methyl-4-(1,2,2-triphenylethenyl)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.172150708 u
Formula C27H22
InChI InChI=1S/C27H22/c1-21-17-19-25(20-18-21)27(24-15-9-4-10-16-24)26(22-11-5-2-6-12-22)23-13-7-3-8-14-23/h2-20H,1H3
InChIKey CNZZQDOFHHSVMJ-UHFFFAOYSA-N
Molecular Weight 346.473 g/mol
SMILES C(=C(C=1C=CC=CC1)C=1C=CC=CC1)(C=1C=CC(=CC1)C)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.943342