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4,4-Dimethyl-2-phenyl-pentanoic acid

View entire compound with spectra: 1 MS (GC)

4,4-Dimethyl-2-phenyl-pentanoic acid
SpectraBase Compound ID KY9BIOGuWKl
InChI InChI=1S/C13H18O2/c1-13(2,3)9-11(12(14)15)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,14,15)
InChIKey UBLGSHNEIFYSKZ-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45ZvyMIv0a4
Name 4,4-Dimethyl-2-phenyl-pentanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-13(2,3)9-11(12(14)15)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,14,15)
InChIKey UBLGSHNEIFYSKZ-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES OC(C(CC(C)(C)C)c1ccccc1)=O
SPLASH splash10-0a4i-9510000000-276c5d138499e57e876f
Source of Spectrum KC-0-1113-1
Synonyms 4,4-Dimethyl-2-phenyl-valeric acid
Wiley ID 830470