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1-Phenylbutane-2,3dione
SpectraBase Compound ID 9VYZDjXpLAy
InChI InChI=1S/C10H10O2/c1-8(11)10(12)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey WZLKRAJHCPNZAA-UHFFFAOYSA-N
Mol Weight 162.19 g/mol
Molecular Formula C10H10O2
Exact Mass 162.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8YwDQImjSN4
Name 1-Phenylbutane-2,3dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O2
InChI InChI=1S/C10H10O2/c1-8(11)10(12)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey WZLKRAJHCPNZAA-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol1024053
Molecular Weight 162.188 g/mol
SMILES CC(C(=O)Cc1ccccc1)=O
SPLASH splash10-03dl-6900000000-8ae24b80824d08f9ebe1
Source of Spectrum A1-13-26/SMS64-13'
Synonyms 1-Phenyl-2,3-butanedione 1-Phenylbutane-2,3-dione
Wiley ID 1749770