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7-AMINO-3-BENZYL-5-ORTHO-CHLOROPHENYL-3H-1,2,3-TRIAZOLO-[4.5-D]-PYRIMIDINE
SpectraBase Compound ID 29EGkCvtXes
InChI InChI=1S/C17H13ClN6/c18-13-9-5-4-8-12(13)16-20-15(19)14-17(21-16)24(23-22-14)10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,19,20,21)
InChIKey YTSJCJICPHRFBM-UHFFFAOYSA-N
Mol Weight 336.79 g/mol
Molecular Formula C17H13ClN6
Exact Mass 336.089022 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FAXiigEPNjH
Name 7-AMINO-3-BENZYL-5-ORTHO-CHLOROPHENYL-3H-1,2,3-TRIAZOLO-[4.5-D]-PYRIMIDINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13ClN6
InChI InChI=1S/C17H13ClN6/c18-13-9-5-4-8-12(13)16-20-15(19)14-17(21-16)24(23-22-14)10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,19,20,21)
InChIKey YTSJCJICPHRFBM-UHFFFAOYSA-N
Literature Reference Author P.L.BARILI,G.BIAGI,O.LIVI,L.MUCCI,V.SCARTONI
Literature Reference Citation J.HETCYCL.CHEM.,24,997(1987)
Literature Reference DOI 10.1002/jhet.5570240419
Molecular Weight 336.783 g/mol
Solvent DMSO-D6
Source File Reference UWED8220