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2,4-Hexanedione, 3,5-dimethyl-1-phenyl-
SpectraBase Compound ID JotKMiqdFbt
InChI InChI=1S/C14H18O2/c1-10(2)14(16)11(3)13(15)9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
InChIKey RSAATEKGHJRLJJ-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 I1ckGvzEb6i
Name 2,4-HEXANDIONE, 3,5-DIMETHYL-1-PHENYL-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-10(2)14(16)11(3)13(15)9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
InChIKey RSAATEKGHJRLJJ-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 218.1302
SMILES CC(C(C(C)C(Cc1ccccc1)=O)=O)C
SPLASH splash10-006x-9200000000-92efe6ac20c139ac2d36
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany