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4'-isobutylacetophenone

View entire compound with spectra: 3 NMR, 2 FTIR, and 6 MS (GC)

4'-isobutylacetophenone
SpectraBase Compound ID CVyIFUyV9rJ
InChI InChI=1S/C12H16O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13/h4-7,9H,8H2,1-3H3
InChIKey KEAGRYYGYWZVPC-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9z49J2dz6ui
Name 4'-(2-Methylpropyl)acetophenone
Alternate Name(s) 1-(4-Isobutylphenyl)ethanone 1-[4-(2-Methylpropyl)phenyl]ethanone 4'-Isobutylacetophenone 4-Isobutylacetophenone Acetophenone, 4-isobutyl- Ethanone, 1-[4-(2-methylpropyl)phenyl]- p-iso-Butylacetophenone
CAS Registry Number 38861-78-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13/h4-7,9H,8H2,1-3H3
InChIKey KEAGRYYGYWZVPC-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES c1c(ccc(C(C)=O)c1)CC(C)C
SPLASH splash10-03dl-4900000000-7ef13b71a06e1e109deb
Wiley ID 1492083