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1-Hydroxy-4,4-dimethyl-3-phenyl-2-pentanone
SpectraBase Compound ID Jtk5i9pzDG1
InChI InChI=1S/C13H18O2/c1-13(2,3)12(11(15)9-14)10-7-5-4-6-8-10/h4-8,12,14H,9H2,1-3H3
InChIKey ZSQVEYWSUWMUEA-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 2HaTbIINxg
Name 1-Hydroxy-4,4-dimethyl-3-phenyl-2-pentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-13(2,3)12(11(15)9-14)10-7-5-4-6-8-10/h4-8,12,14H,9H2,1-3H3
InChIKey ZSQVEYWSUWMUEA-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES OCC(C(C(C)(C)C)c1ccccc1)=O
SPLASH splash10-0zfu-4900000000-548976fbca45aaa72e79
Source of Spectrum F-50-12325-3
Synonyms 1-Hydroxy-4,4-dimethyl-3-phenyl-pentan-2-one 4,4-Dimethyl-1-oxidanyl-3-phenyl-pentan-2-one
Wiley ID 789839