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4,4-dimethyl-1-phenylpentan-1-one
SpectraBase Compound ID 9jWJmYKnpXm
InChI InChI=1S/C13H18O/c1-13(2,3)10-9-12(14)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKey WHQVWTONTCQFHT-UHFFFAOYSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3Vd1pW5VXe
Name 4,4-Dimethyl-1-phenyl-1-pentanone
CAS Registry Number 37608-93-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-13(2,3)10-9-12(14)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKey WHQVWTONTCQFHT-UHFFFAOYSA-N
Molecular Weight 190.286 g/mol
SMILES C(=O)(CCC(C)(C)C)c1ccccc1
SPLASH splash10-0a4i-2900000000-c9325516f3caf0e17c83
Source of Spectrum K-125-1213-20
Synonyms 4,4-Dimethyl-1-phenyl-pentan-1-one 4,4-Dimethyl-1-phenylpentan-1-one
Wiley ID 1187068