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9-AMINO-5-(2-METHANESULFINYLPYRIMIDIN-4-YL)-PYRIDO-[3',2':4,5]-PYRROLO-[1,2-C]-PYRIMIDINE
SpectraBase Compound ID IdETUrLjxXq
InChI InChI=1S/C15H12N6OS/c1-23(22)15-19-7-4-10(20-15)12-9-3-2-6-17-13(9)21-11(12)5-8-18-14(21)16/h2-8H,1H3,(H2,16,18)
InChIKey NUNRNIDZUNBDCE-UHFFFAOYSA-N
Mol Weight 324.36 g/mol
Molecular Formula C15H12N6OS
Exact Mass 324.07933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7vBuIsqqpPP
Name 5-(2-Methanesulfinyl-pyrimidin-4-yl)-pyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidin-9-ylamine
Alternate Name(s) 5-[2-(methylsulfinyl)-4-pyrimidinyl]pyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidin-9-amine 5-[2-(methylsulfinyl)-4-pyrimidinyl]pyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidin-9-ylamine 9-Amino-5-(2-methanesulfanylpyrimidin-4-yl)pyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidine 5-(2-methylsulfinyl-4-pyrimidinyl)-9-pyrido[2,3]pyrrolo[4,5-c]pyrimidinamine 5-(2-methylsulfinylpyrimidin-4-yl)pyrido[2,3]pyrrolo[4,5-c]pyrimidin-9-amine
Comments Less than 3 mono-isotopic peaks
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Formula C15H12N6OS
InChI InChI=1S/C15H12N6OS/c1-23(22)15-19-7-4-10(20-15)12-9-3-2-6-17-13(9)21-11(12)5-8-18-14(21)16/h2-8H,1H3,(H2,16,18)
InChIKey NUNRNIDZUNBDCE-UHFFFAOYSA-N
Molecular Weight 324.362 g/mol
SMILES NC=1[n]2c(c(-c3nc(S(=O)C)ncc3)c3c2nccc3)C=CN1
SPLASH splash10-03di-0095000000-ae2f1a364d8ca3cbd557
Source of Spectrum F-68-10029-21
Wiley ID 1573995