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

*Links on SpectraBase are not permalinks.
3-Methyl-3-(4-methylphenyl)-2-butanone
SpectraBase Compound ID 3KkZs3sRILF
InChI InChI=1S/C12H16O/c1-9-5-7-11(8-6-9)12(3,4)10(2)13/h5-8H,1-4H3
InChIKey ZIYLSBHBLCBTJB-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 B46jCtLDIPY
Name 3-Methyl-3-(4-methylphenyl)-2-butanone
Alternate Name(s) 3-Methyl-3-(4-methylphenyl)butan-2-one 3-Methyl-3-(p-tolyl)butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-9-5-7-11(8-6-9)12(3,4)10(2)13/h5-8H,1-4H3
InChIKey ZIYLSBHBLCBTJB-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES C(C(=O)C)(c1ccc(cc1)C)(C)C
SPLASH splash10-000x-6900000000-36a795e9c9469b121817
Source of Spectrum Y4-79-8-3
Wiley ID 1513088