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

*Links on SpectraBase are not permalinks.
1-(4-Chlorophenyl)-2,2-dimethylbut-3-en-1-one
SpectraBase Compound ID 142RYdCYB6o
InChI InChI=1S/C12H13ClO/c1-4-12(2,3)11(14)9-5-7-10(13)8-6-9/h4-8H,1H2,2-3H3
InChIKey SMSZOLVLMOKSOB-UHFFFAOYSA-N
Mol Weight 208.69 g/mol
Molecular Formula C12H13ClO
Exact Mass 208.065493 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 2DJqweaiI5N
Name 1-(4-Chlorophenyl)-2,2-dimethylbut-3-en-1-one
Appearance Colourless oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13ClO
InChI InChI=1S/C12H13ClO/c1-4-12(2,3)11(14)9-5-7-10(13)8-6-9/h4-8H,1H2,2-3H3
InChIKey SMSZOLVLMOKSOB-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890 or 5890 Series II
Ionization Type EI
Molecular Weight 208.688 g/mol
Reported Formula C12H13ClO
SMILES C=CC(C(c1ccc(cc1)Cl)=O)(C)C
SPLASH splash10-05r0-6900000000-0e3e84ea22520b6cd9ee
Source of Spectrum EP3070083A1
Wiley ID 1851011