For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-Methyl-1-phenyl-1,5-hexadiene isomer

View entire compound with spectra: 1 NMR, and 3 MS (GC)

2-Methyl-1-phenyl-1,5-hexadiene isomer
SpectraBase Compound ID 4sXuQt1ae9C
InChI InChI=1S/C13H16/c1-3-4-8-12(2)11-13-9-6-5-7-10-13/h3,5-7,9-11H,1,4,8H2,2H3/b12-11+
InChIKey CKBGSMCNYULSRY-VAWYXSNFSA-N
Mol Weight 172.27 g/mol
Molecular Formula C13H16
Exact Mass 172.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8uOVr4XQKLf
Name 2-Methyl-1-phenyl-1,5-hexadiene isomer
Alternate Name(s) [(1E)-2-methylhexa-1,5-dienyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-3-4-8-12(2)11-13-9-6-5-7-10-13/h3,5-7,9-11H,1,4,8H2,2H3/b12-11+
InChIKey CKBGSMCNYULSRY-VAWYXSNFSA-N
Molecular Weight 172.271 g/mol
SMILES C(\C(=C\c1ccccc1)C)CC=C
SPLASH splash10-004l-7900000000-29c82e16b031b0ce080c
Source of Spectrum O1-25-83-7
Wiley ID 1536659