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(3E,5E,7E)-10-Phenyl-2-methyl-5-bromo-deca-3,5,7-triene

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

(3E,5E,7E)-10-Phenyl-2-methyl-5-bromo-deca-3,5,7-triene
SpectraBase Compound ID EFIN6Evik11
InChI InChI=1S/C17H21Br/c1-15(2)13-14-17(18)12-8-4-7-11-16-9-5-3-6-10-16/h3-6,8-10,12-15H,7,11H2,1-2H3/b8-4+,14-13+,17-12+
InChIKey WEPFHZNCVZJJAW-BIHOVAIWSA-N
Mol Weight 305.26 g/mol
Molecular Formula C17H21Br
Exact Mass 304.082664 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID qaHvSLuG6X
Name (3E,5E,7E)-10-Phenyl-2-methyl-5-bromo-deca-3,5,7-triene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.082663676 u
Formula C17H21Br
InChI InChI=1S/C17H21Br/c1-15(2)13-14-17(18)12-8-4-7-11-16-9-5-3-6-10-16/h3-6,8-10,12-15H,7,11H2,1-2H3/b8-4+,14-13+,17-12+
InChIKey WEPFHZNCVZJJAW-BIHOVAIWSA-N
Molecular Weight 305.259 g/mol
SMILES C(\C=C\C=C/(\C=C\C(C)C)Br)CC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.858736