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6-(3,5-Dimethoxyphenyl)hexane-2,4-dione
SpectraBase Compound ID D50Ypy3aHoB
InChI InChI=1S/C14H18O4/c1-10(15)6-12(16)5-4-11-7-13(17-2)9-14(8-11)18-3/h7-9H,4-6H2,1-3H3
InChIKey PQEHCCHQALQQGI-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9AH2jgTmR2M
Name 6-(3,5-Dimethoxyphenyl)-2,4-hexanedione
Appearance Clear oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-10(15)6-12(16)5-4-11-7-13(17-2)9-14(8-11)18-3/h7-9H,4-6H2,1-3H3
InChIKey PQEHCCHQALQQGI-UHFFFAOYSA-N
Instrument Name HP 5890 series
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.9.167
Molecular Weight 250.294 g/mol
SMILES COc1cc(cc(c1)CCC(CC(C)=O)=O)OC
SPLASH splash10-014i-3920000000-6f997d187443dfbc0aa3
Source of Spectrum BJO-9-SM2-1d
Wiley ID 1853719