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1-(6-Amino-5-cyano-4-phenylpyrimidin-2-yl)-4-(2-hydroxyethyl)-3-methyl-3-pyrazolin-5-one
SpectraBase Compound ID D1WmM0cS19o
InChI InChI=1S/C17H16N6O2/c1-10-12(7-8-24)16(25)23(22-10)17-20-14(11-5-3-2-4-6-11)13(9-18)15(19)21-17/h2-6,22,24H,7-8H2,1H3,(H2,19,20,21)
InChIKey FLOYQIHKMRIQLA-UHFFFAOYSA-N
Mol Weight 336.35 g/mol
Molecular Formula C17H16N6O2
Exact Mass 336.133474 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Asb3klffsLh
Name 1-(6-Amino-5-cyano-4-phenylpyrimidin-2-yl)-4-(2-hydroxyethyl)-3-methyl-3-pyrazolin-5-one
Alternate Name(s) 4-Amino-2-(4-(2-hydroxyethyl)-3-methyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl)-6-phenylpyrimidine-5-carbonitrile 4-Amino-2-[4-(2-hydroxyethyl)-5-methyl-3-oxo-1H-pyrazol-2-yl]-6-phenyl-5-pyrimidinecarbonitrile 4-Amino-2-[4-(2-hydroxyethyl)-5-methyl-3-oxo-1H-pyrazol-2-yl]-6-phenylpyrimidine-5-carbonitrile 4-Amino-2-[4-(2-hydroxyethyl)-5-methyl-3-oxo-1H-pyrazol-2-yl]-6-phenyl-pyrimidine-5-carbonitrile 4-Azanyl-2-[4-(2-hydroxyethyl)-5-methyl-3-oxidanylidene-1H-pyrazol-2-yl]-6-phenyl-pyrimidine-5-carbonitrile
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Formula C17H16N6O2
InChI InChI=1S/C17H16N6O2/c1-10-12(7-8-24)16(25)23(22-10)17-20-14(11-5-3-2-4-6-11)13(9-18)15(19)21-17/h2-6,22,24H,7-8H2,1H3,(H2,19,20,21)
InChIKey FLOYQIHKMRIQLA-UHFFFAOYSA-N
Molecular Weight 336.355 g/mol
SMILES Nc1nc(N2C(C(CCO)=C(N2)C)=O)nc(c1C#N)-c1ccccc1
SPLASH splash10-0a4i-1609000000-6ea147ede02a63025573
Source of Spectrum EMC-41-162-7
Wiley ID 1734531