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1-Hydroxy-4,4-dimethyl-2-phenyl-3-pentanone
SpectraBase Compound ID BhxqutEJpt1
InChI InChI=1S/C13H18O2/c1-13(2,3)12(15)11(9-14)10-7-5-4-6-8-10/h4-8,11,14H,9H2,1-3H3
InChIKey XWOQSMHLVUAKEQ-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 DWLOWKeNid8
Name 1-Hydroxy-4,4-dimethyl-2-phenyl-3-pentanone
Alternate Name(s) 1-Hydroxy-4,4-dimethyl-2-phenylpentan-3-one 4,4-Dimethyl-1-oxidanyl-2-phenyl-pentan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-13(2,3)12(15)11(9-14)10-7-5-4-6-8-10/h4-8,11,14H,9H2,1-3H3
InChIKey XWOQSMHLVUAKEQ-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES OCC(C(C(C)(C)C)=O)c1ccccc1
SPLASH splash10-0zfr-8900000000-3cea0dd2ce17ffdf32e3
Source of Spectrum F-50-12325-4
Wiley ID 789838