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2,4-Heptanedione, 6-methyl-1-phenyl-

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

2,4-Heptanedione, 6-methyl-1-phenyl-
SpectraBase Compound ID 7rfcczHo8Oq
InChI InChI=1S/C14H18O2/c1-11(2)8-13(15)10-14(16)9-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3
InChIKey JOMHLQUFIUPINW-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 1BvvAYRYQC2
Name 2,4-Heptanedione, 6-methyl-1-phenyl-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-11(2)8-13(15)10-14(16)9-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3
InChIKey JOMHLQUFIUPINW-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES c1cc(ccc1)CC(=O)CC(=O)CC(C)C
SPLASH splash10-004i-6910000000-7d96d85ada9cef4f5216
Synonyms 6-Methyl-1-phenyl-2,4-heptanedione 6-Methyl-1-phenyl-heptane-2,4-dione
Wiley ID 1492022