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3,4-bis(phenylcarbonyl)hexane-2,5-dione
SpectraBase Compound ID 6qTZ5II94Cb
InChI InChI=1S/C20H18O4/c1-13(21)17(19(23)15-9-5-3-6-10-15)18(14(2)22)20(24)16-11-7-4-8-12-16/h3-12,17-18H,1-2H3
InChIKey IIHNJBVVXUOWFC-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C20H18O4
Exact Mass 322.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AvQUFC6amJT
Name 3,4-bis(phenylcarbonyl)hexane-2,5-dione
CAS Registry Number 51439-47-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O4
InChI InChI=1S/C20H18O4/c1-13(21)17(19(23)15-9-5-3-6-10-15)18(14(2)22)20(24)16-11-7-4-8-12-16/h3-12,17-18H,1-2H3
InChIKey IIHNJBVVXUOWFC-UHFFFAOYSA-N
Molecular Weight 322.360 g/mol
SMILES C(=O)(C(C(C(=O)c1ccccc1)C(C)=O)C(C)=O)c1ccccc1
SPLASH splash10-0a4i-0900000000-5e0c7f49da02347f2224
Source of Spectrum F-44-1606-2
Synonyms 3,4-Dibenzoylhexane-2,5-dione
Wiley ID 1321902