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3-(2-Methylsulfanylpyrimidin-5-yl)-1H-pyrrolo[2,3-b]pyridine
SpectraBase Compound ID 4Y9H05ugUpJ
InChI InChI=1S/C12H10N4S/c1-17-12-15-5-8(6-16-12)10-7-14-11-9(10)3-2-4-13-11/h2-7H,1H3,(H,13,14)
InChIKey FOQAQUYAZHPDJV-UHFFFAOYSA-N
Mol Weight 242.3 g/mol
Molecular Formula C12H10N4S
Exact Mass 242.062618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F80GXDl7hsT
Name 3-(2-Methylsulfanylpyrimidin-5-yl)-1H-pyrrolo[2,3-b]pyridine
Alternate Name(s) 3-[2-(methylthio)-5-pyrimidinyl]-1H-pyrrolo[2,3-b]pyridine 3-[2-(methylthio)pyrimidin-5-yl]-1H-pyrrolo[2,3-b]pyridine
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Formula C12H10N4S
InChI InChI=1S/C12H10N4S/c1-17-12-15-5-8(6-16-12)10-7-14-11-9(10)3-2-4-13-11/h2-7H,1H3,(H,13,14)
InChIKey FOQAQUYAZHPDJV-UHFFFAOYSA-N
Molecular Weight 242.300 g/mol
SMILES [nH]1c2c(c(c1)-c1cnc(nc1)SC)cccn2
SPLASH splash10-0006-0590000000-633d260ba986c78b5d7c
Source of Spectrum SO-0-620-6
Wiley ID 876491