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2-(4-CHLOROPHENYL)-AMINO-3-ISOPROPYLPTERIDIN-4(3H)-ONE
SpectraBase Compound ID 5SNwO7s9RIB
InChI InChI=1S/C15H14ClN5O/c1-9(2)21-14(22)12-13(18-8-7-17-12)20-15(21)19-11-5-3-10(16)4-6-11/h3-9H,1-2H3,(H,18,19,20)
InChIKey IXDJBCDJJVPLFM-UHFFFAOYSA-N
Mol Weight 315.76 g/mol
Molecular Formula C15H14ClN5O
Exact Mass 315.088688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bn88c5jmJYu
Name 2-(4-CHLOROPHENYL)-AMINO-3-ISOPROPYLPTERIDIN-4(3H)-ONE
Compound Number 5F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H14ClN5O
InChI InChI=1S/C15H14ClN5O/c1-9(2)21-14(22)12-13(18-8-7-17-12)20-15(21)19-11-5-3-10(16)4-6-11/h3-9H,1-2H3,(H,18,19,20)
InChIKey IXDJBCDJJVPLFM-UHFFFAOYSA-N
Literature Reference Author T.OKAWA,M.KAWASE,S.EGUCHI,A.KAEHI,M.SHIRO
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2277(1998)
Literature Reference DOI 10.1039/a803529f
Molecular Weight 315.762 g/mol
Solvent DMSO-D6
Source File Reference UWGE3946