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4,4-Dimethyl-1-phenylpentan-3-one
SpectraBase Compound ID 70iNontfIEc
InChI InChI=1S/C13H18O/c1-13(2,3)12(14)10-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKey ABLXCWZAGVGYGN-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 oJVYc4oN77
Name 4,4-Dimethyl-1-phenylpentan-3-one
Alternate Name(s) 4,4-Dimethyl-1-phenyl-3-pentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-13(2,3)12(14)10-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKey ABLXCWZAGVGYGN-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol302145a
Molecular Weight 190.286 g/mol
SMILES C(C)(C(CCc1ccccc1)=O)(C)C
SPLASH splash10-0a5c-5900000000-1324790969df1f2bce45
Source of Spectrum A1-14-4703/SMS5-3m
Wiley ID 1750623