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1,5-Dihydroxy-4-methyl-1-phenyl-3-pentanone

View entire compound with spectra: 4 MS (GC)

1,5-Dihydroxy-4-methyl-1-phenyl-3-pentanone
SpectraBase Compound ID KhcdvysYVFI
InChI InChI=1S/C12H16O3/c1-9(8-13)11(14)7-12(15)10-5-3-2-4-6-10/h2-6,9,12-13,15H,7-8H2,1H3
InChIKey POTVZQBETZFFRB-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tUcdKH4j1e
Name 1,5-Dihydroxy-4-methyl-1-phenyl-3-pentanone
Alternate Name(s) 1,5-Dihydroxy-4-methyl-1-phenyl-pentan-3-one 4-Methyl-1,5-bis(oxidanyl)-1-phenyl-pentan-3-one
CAS Registry Number 117202-05-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-9(8-13)11(14)7-12(15)10-5-3-2-4-6-10/h2-6,9,12-13,15H,7-8H2,1H3
InChIKey POTVZQBETZFFRB-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES OC(CC(C(CO)C)=O)c1ccccc1
SPLASH splash10-0a6r-4900000000-525487d1cb54b93c2488
Source of Spectrum C-112-6978-84
Wiley ID 1206935