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1-Phenyl-1-(1'-naphthyl)-3-methylbuta-1,2-diene

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

1-Phenyl-1-(1'-naphthyl)-3-methylbuta-1,2-diene
SpectraBase Compound ID 6gvCn5cI6Km
InChI InChI=1S/C21H18/c1-16(2)15-21(18-9-4-3-5-10-18)20-14-8-12-17-11-6-7-13-19(17)20/h3-14H,1-2H3
InChIKey NAKFQCSIDVMILM-UHFFFAOYSA-N
Mol Weight 270.37 g/mol
Molecular Formula C21H18
Exact Mass 270.140851 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IhW6u4KdIaH
Name 1-Phenyl-1-(1'-naphthyl)-3-methylbuta-1,2-diene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.140850580 u
Formula C21H18
InChI InChI=1S/C21H18/c1-16(2)15-21(18-9-4-3-5-10-18)20-14-8-12-17-11-6-7-13-19(17)20/h3-14H,1-2H3
InChIKey NAKFQCSIDVMILM-UHFFFAOYSA-N
Molecular Weight 270.375 g/mol
SMILES C(=C=C(C)C)(C=1C=CC=C2C=CC=CC12)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.875824