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Benzene, 1,1',1'',1'''-(1,3-butadiene-2,4-diyl-1-ylidene)tetrakis-
SpectraBase Compound ID HP27OTingol
InChI InChI=1S/C28H22/c1-5-13-23(14-6-1)21-22-27(24-15-7-2-8-16-24)28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H/b22-21+
InChIKey BFLCAHANJFUGDT-QURGRASLSA-N
Mol Weight 358.48 g/mol
Molecular Formula C28H22
Exact Mass 358.172151 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7cOg7YjF6y2
Name Benzene, 1,1',1'',1'''-(1,3-butadiene-2,4-diyl-1-ylidene)tetrakis-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.172150708 u
Formula C28H22
InChI InChI=1S/C28H22/c1-5-13-23(14-6-1)21-22-27(24-15-7-2-8-16-24)28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H/b22-21+
InChIKey BFLCAHANJFUGDT-QURGRASLSA-N
Molecular Weight 358.484 g/mol
SMILES C(=C(C=1C=CC=CC1)C=1C=CC=CC1)(\C=C\C1=CC=CC=C1)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966365