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5,6-DICYANO-1H-BENZOTRIAZOLE

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5,6-DICYANO-1H-BENZOTRIAZOLE
SpectraBase Compound ID 5WIVJOPvy7Q
InChI InChI=1S/C8H3N5/c9-3-5-1-7-8(12-13-11-7)2-6(5)4-10/h1-2H,(H,11,12,13)
InChIKey DOBRSOMSFCYWPN-UHFFFAOYSA-N
Mol Weight 169.15 g/mol
Molecular Formula C8H3N5
Exact Mass 169.038845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CNaQQudVlN7
Name 5,6-DICYANO-1H-BENZOTRIAZOLE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H3N5
InChI InChI=1S/C8H3N5/c9-3-5-1-7-8(12-13-11-7)2-6(5)4-10/h1-2H,(H,11,12,13)
InChIKey DOBRSOMSFCYWPN-UHFFFAOYSA-N
Literature Reference Author S.VAGIN,A.FRICKENSCHMIDT,B.KAMMERER,M.HANACK
Literature Reference Citation EUR.J.ORG.CHEM.,3271(2005)
Literature Reference DOI 10.1002/ejoc.200500105
Molecular Weight 169.145 g/mol
Sample ID 30042
Solvent DMSO-D6