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1,4-Pentanedione, 1-[2-(acetyloxy)phenyl]-3-phenyl-
SpectraBase Compound ID 2R2sxugetAu
InChI InChI=1S/C19H18O4/c1-13(20)17(15-8-4-3-5-9-15)12-18(22)16-10-6-7-11-19(16)23-14(2)21/h3-11,17H,12H2,1-2H3
InChIKey MZUCZWAATDDKFV-UHFFFAOYSA-N
Mol Weight 310.35 g/mol
Molecular Formula C19H18O4
Exact Mass 310.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EUHGx9ndcGp
Name 1,4-Pentanedione, 1-[2-(acetyloxy)phenyl]-3-phenyl-
Alternate Name(s) 1-(2-Acetoxyphenyl)-3-phenyl-1,4-pentanedione 2-(4-oxo-3-phenylpentanoyl)phenyl acetate
CAS Registry Number 113344-29-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O4
InChI InChI=1S/C19H18O4/c1-13(20)17(15-8-4-3-5-9-15)12-18(22)16-10-6-7-11-19(16)23-14(2)21/h3-11,17H,12H2,1-2H3
InChIKey MZUCZWAATDDKFV-UHFFFAOYSA-N
Molecular Weight 310.349 g/mol
SMILES C(c1c(OC(=O)C)cccc1)(CC(C(=O)C)c1ccccc1)=O
SPLASH splash10-0006-9510000000-cdf849cf25833c26b278
Source of Spectrum AH-121-274-12
Wiley ID 1311726