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2,4-Hexanedione, 5,5-dimethyl-1-phenyl-

View entire compound with spectra: 1 NMR, and 2 MS (GC)

2,4-Hexanedione, 5,5-dimethyl-1-phenyl-
SpectraBase Compound ID CiEYIPl0c2T
InChI InChI=1S/C14H18O2/c1-14(2,3)13(16)10-12(15)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKey PSJHYOUOXJTAAJ-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CPdZPOfiuH
Name 2,4-Hexanedione, 5,5-dimethyl-1-phenyl-
CAS Registry Number 136346-95-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-14(2,3)13(16)10-12(15)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKey PSJHYOUOXJTAAJ-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES c1cc(ccc1)CC(=O)CC(=O)C(C)(C)C
SPLASH splash10-004l-8920000000-2beba64b2b7f6c21dd6c
Synonyms 5,5-Dimethyl-1-phenyl-2,4-hexanedione 5,5-Dimethyl-1-phenyl-hexane-2,4-dione
Wiley ID 1491845