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HSECVGUAJKCHOV-UHFFFAOYSA-N
SpectraBase Compound ID KdHb5Jii0xR
InChI InChI=1S/C15H12ClN5OS/c1-23-15-20-13-11(14(22)21-15)10(9(6-17)12(18)19-13)7-2-4-8(16)5-3-7/h2-5,10H,18H2,1H3,(H2,19,20,21,22)
InChIKey HSECVGUAJKCHOV-UHFFFAOYSA-N
Mol Weight 345.81 g/mol
Molecular Formula C15H12ClN5OS
Exact Mass 345.045109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AS7p4PY2nAI
Name 7-AMINO-5-(4-CHLOROPHENYL)-6-CYANO-5,8-DIHYDRO-2-METHYLTHIO-PYRIDO-[2,3-D]-PYRIMIDIN-4(3H)-ONE
Compound Number 3 E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H12ClN5OS
InChI InChI=1S/C15H12ClN5OS/c1-23-15-20-13-11(14(22)21-15)10(9(6-17)12(18)19-13)7-2-4-8(16)5-3-7/h2-5,10H,18H2,1H3,(H2,19,20,21,22)
InChIKey HSECVGUAJKCHOV-UHFFFAOYSA-N
Literature Reference Author J.QUIROGA,M.ALVARADO,B.INSUASTY,M.NOGUERAS,A.SANCHEZ,J.COBO
Literature Reference Citation J.HETCYCL.CHEM.,35,1309(1998)
Literature Reference DOI 10.1002/jhet.5570350612
Molecular Weight 345.806 g/mol
Solvent DMSO-D6
Source File Reference UWCS25115