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3-PARA-CHLOROBENZYL-4-AMINO-5-CYANOMETHYL-4H-1,2,4-TRIAZOLE-HYDROCHLORIDE

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3-PARA-CHLOROBENZYL-4-AMINO-5-CYANOMETHYL-4H-1,2,4-TRIAZOLE-HYDROCHLORIDE
SpectraBase Compound ID AQAaJx3aPVt
InChI InChI=1S/C11H10ClN5.ClH/c12-9-3-1-8(2-4-9)7-11-16-15-10(5-6-13)17(11)14;/h1-4H,5,7,14H2;1H
InChIKey SPSIQPANZOWUQJ-UHFFFAOYSA-N
Mol Weight 284.15 g/mol
Molecular Formula C11H11Cl2N5
Exact Mass 283.039151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ewqWeuMCdC
Name 3-PARA-CHLOROBENZYL-4-AMINO-5-CYANOMETHYL-4H-1,2,4-TRIAZOLE-HYDROCHLORIDE
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11Cl2N5
InChI InChI=1S/C11H10ClN5.ClH/c12-9-3-1-8(2-4-9)7-11-16-15-10(5-6-13)17(11)14;/h1-4H,5,7,14H2;1H
InChIKey SPSIQPANZOWUQJ-UHFFFAOYSA-N
Literature Reference Author N.DEMIRBAS,A.DEMIRBAS,K.SANCAK
Literature Reference Citation TURK.J.CHEM.,26,801(2002)
Molecular Weight 284.148 g/mol
Solvent DMSO-D6
Source File Reference UWLU5822