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1H-1,2,3-Triazol-5-amine, 4-(1H-1,3-benzimidazol-2-yl)-1-(4-chlorophenyl)-

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1H-1,2,3-Triazol-5-amine, 4-(1H-1,3-benzimidazol-2-yl)-1-(4-chlorophenyl)-
SpectraBase Compound ID 9n6W4wXpn0J
InChI InChI=1S/C15H11ClN6/c16-9-5-7-10(8-6-9)22-14(17)13(20-21-22)15-18-11-3-1-2-4-12(11)19-15/h1-8H,17H2,(H,18,19)
InChIKey KRICHNROHRWJCG-UHFFFAOYSA-N
Mol Weight 310.75 g/mol
Molecular Formula C15H11ClN6
Exact Mass 310.073372 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CLRpUCl0mGf
Name 1H-1,2,3-Triazol-5-amine, 4-(1H-1,3-benzimidazol-2-yl)-1-(4-chlorophenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.073372078 u
Formula C15H11ClN6
InChI InChI=1S/C15H11ClN6/c16-9-5-7-10(8-6-9)22-14(17)13(20-21-22)15-18-11-3-1-2-4-12(11)19-15/h1-8H,17H2,(H,18,19)
InChIKey KRICHNROHRWJCG-UHFFFAOYSA-N
Molecular Weight 310.748 g/mol
SMILES C1(=C(N(C2=CC=C(C=C2)Cl)N=N1)N)C1=NC2=CC=CC=C2N1