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3-(1,2-dihydro-4-hydroxy-1-methyl-2-oxoquinolin-3-yl)-3-oxopropanal
SpectraBase Compound ID 960aBzm11C6
InChI InChI=1S/C13H11NO4/c1-14-9-5-3-2-4-8(9)12(17)11(13(14)18)10(16)6-7-15/h2-5,7,17H,6H2,1H3
InChIKey HEEHYANIIYJICQ-UHFFFAOYSA-N
Mol Weight 245.23 g/mol
Molecular Formula C13H11NO4
Exact Mass 245.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GozjsiBsUGc
Name 3-(1,2-dihydro-4-hydroxy-1-methyl-2-oxoquinolin-3-yl)-3-oxopropanal
Appearance Yellow crystalline solid
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Formula C13H11NO4
InChI InChI=1S/C13H11NO4/c1-14-9-5-3-2-4-8(9)12(17)11(13(14)18)10(16)6-7-15/h2-5,7,17H,6H2,1H3
InChIKey HEEHYANIIYJICQ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMSqp 1000 ex
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2952
Molecular Weight 245.234 g/mol
SMILES OC1=C(C(N(c2c1cccc2)C)=O)C(CC=O)=O
SPLASH splash10-0kdi-2980000000-494e63fbade639aef0fe
Source of Spectrum Y-54-3326-5
Thin-Layer Chromatography Rf = 0.4 (ethyl acetate/hexane, 1:1)
Wiley ID 1878659