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4-Hydroxy-3-[1'-phenyl-3'-oxobutyl]-2H-[1]-benzopyran-2-one - Oxime
SpectraBase Compound ID 7kBDg6WsGHD
InChI InChI=1S/C19H17NO4/c1-12(20-23)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)24-19(17)22/h2-10,15,21,23H,11H2,1H3/b20-12+
InChIKey MJTNJRLGWGUYMY-UDWIEESQSA-N
Mol Weight 323.35 g/mol
Molecular Formula C19H17NO4
Exact Mass 323.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BFBL2VWNixa
Name 4-Hydroxy-3-[1'-phenyl-3'-oxobutyl]-2H-[1]-benzopyran-2-one - Oxime
Alternate Name(s) 4-Hydroxy-3-[(3E)-3-(hydroxyimino)-1-phenylbutyl]-2H-chromen-2-one 4-Hydroxy-3-[(3E)-3-hydroxyimino-1-phenylbutyl]-1-benzopyran-2-one 4-Hydroxy-3-[(3E)-3-hydroxyimino-1-phenylbutyl]chromen-2-one 4-Hydroxy-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-2-one Oxime 4-Hydroxy-3-[(3E)-3-hydroxyimino-1-phenyl-butyl]chromen-2-one 3-[(3E)-3-hydroxyimino-1-phenyl-butyl]-4-oxidanyl-chromen-2-one (E)-4-hydroxy-3-(3-(hydroxyimino)-1-phenylbutyl)-2H-chromen-2-one
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Formula C19H17NO4
InChI InChI=1S/C19H17NO4/c1-12(20-23)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)24-19(17)22/h2-10,15,21,23H,11H2,1H3/b20-12+
InChIKey MJTNJRLGWGUYMY-UDWIEESQSA-N
Literature Reference DOI 10.1002_(SICI)1521-4184(19997)332_7_243
Molecular Weight 323.348 g/mol
SMILES O\N=C\(CC(C=1C(Oc2c(C1O)cccc2)=O)c1ccccc1)C
SPLASH splash10-00dl-3910000000-4977f003b98048159f65
Source of Spectrum APP-332-247-2
Wiley ID 1770343