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3-(4-Hydroxy-2(1H)-oxo-3-quinolyl)propionitrile
SpectraBase Compound ID 7dcW6aqW5KD
InChI InChI=1S/C12H10N2O2/c13-7-3-5-9-11(15)8-4-1-2-6-10(8)14-12(9)16/h1-2,4,6H,3,5H2,(H2,14,15,16)
InChIKey XATUTECXTWRUMA-UHFFFAOYSA-N
Mol Weight 214.22 g/mol
Molecular Formula C12H10N2O2
Exact Mass 214.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E05WMKq2MC7
Name 3-(4-Hydroxy-2(1H)-oxo-3-quinolyl)propionitrile
CAS Registry Number 201601-34-5
Comments Structure changed after expert review
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Formula C12H10N2O2
InChI InChI=1S/C12H10N2O2/c13-7-3-5-9-11(15)8-4-1-2-6-10(8)14-12(9)16/h1-2,4,6H,3,5H2,(H2,14,15,16)
InChIKey XATUTECXTWRUMA-UHFFFAOYSA-N
Molecular Weight 214.224 g/mol
SMILES N1c2c(C(=C(CCC#N)C1=O)O)cccc2
SPLASH splash10-006x-9510000000-170df318028629c928b0
Synonyms 3-(4-Hydroxy-2-oxo-1,2-dihydro-3-quinolinyl)propanenitrile 3-(4-hydroxy-2-oxo-1H-quinolin-3-yl)propanenitrile 3-(4-oxidanyl-2-oxidanylidene-1H-quinolin-3-yl)propanenitrile 3-(4-hydroxy-2-keto-1H-quinolin-3-yl)propionitrile
Wiley ID 1468313