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

*Links on SpectraBase are not permalinks.
BENZENEBUTANAL, gamma,4-DIMETHYL-
SpectraBase Compound ID BN3kN5u0LSQ
InChI InChI=1S/C12H16O/c1-10-5-7-12(8-6-10)11(2)4-3-9-13/h5-9,11H,3-4H2,1-2H3
InChIKey XPYKOJLMORBJQP-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 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 8ozlM2LKRqo
Name 4-(4-Methylphenyl)pentanal
Alternate Name(s) 4-(p-tolyl)pentanal 4-(p-tolyl)valeraldehyde Benzenebutanal, .gamma.,4-dimethyl-
CAS Registry Number 4895-19-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-10-5-7-12(8-6-10)11(2)4-3-9-13/h5-9,11H,3-4H2,1-2H3
InChIKey XPYKOJLMORBJQP-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES Cc1ccc(cc1)C(C)CCC=O
SPLASH splash10-0159-4900000000-1d1de3d896a08adc2759
Wiley ID 1488863