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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 8LvwdEbnzsp
Name 2,4-HEPTANDION, 6-METHYL-1-PHENYL-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Instrument Name 311A
Molecular Weight 218.1302
SMILES c1(CC(CC(CC(C)C)=O)=O)ccccc1
SPLASH splash10-004i-6910000000-a6e50c40925f8e979b0e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany