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2-[4-AMINO-(2-METHYLPYRIMIDINE-5-YL)-METHYL]-ISOQUINOLIN-1(2H)-ONE
SpectraBase Compound ID FxQjAx9ul6W
InChI InChI=1S/C15H14N4O/c1-10-17-8-12(14(16)18-10)9-19-7-6-11-4-2-3-5-13(11)15(19)20/h2-8H,9H2,1H3,(H2,16,17,18)
InChIKey NZNYGRIZDUBFHL-UHFFFAOYSA-N
Mol Weight 266.3 g/mol
Molecular Formula C15H14N4O
Exact Mass 266.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tjtvzciHVq
Name 2-[(4'-Amino-2'-methylpyrimidin-5'-yl)methyl]-isoquinolin-1(2H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C15H14N4O
InChI InChI=1S/C15H14N4O/c1-10-17-8-12(14(16)18-10)9-19-7-6-11-4-2-3-5-13(11)15(19)20/h2-8H,9H2,1H3,(H2,16,17,18)
InChIKey NZNYGRIZDUBFHL-UHFFFAOYSA-N
Molecular Weight 266.304 g/mol
SMILES Nc1nc(ncc1CN1C(c2ccccc2C=C1)=O)C
SPLASH splash10-00xr-0960000000-36630e22269593c2a892
Source of Spectrum D8-329-53-11
Synonyms 2-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-1(2H)-isoquinolinone
Wiley ID 1516077