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5-METHYL-6H-PYRAZOLO-[2,3-A]-[1,3,5]-BENZOTRIAZEPINE-3-CARBONITRILE
SpectraBase Compound ID HI7kKJEa2hB
InChI InChI=1S/C12H9N5/c1-8-15-10-4-2-3-5-11(10)17-12(16-8)9(6-13)7-14-17/h2-5,7H,1H3,(H,15,16)
InChIKey LREZTCPBFLWVCT-UHFFFAOYSA-N
Mol Weight 223.24 g/mol
Molecular Formula C12H9N5
Exact Mass 223.085795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E7kYGcJ4bUb
Name 5-METHYL-6H-PYRAZOLO-[2,3-A]-[1,3,5]-BENZOTRIAZEPINE-3-CARBONITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9N5
InChI InChI=1S/C12H9N5/c1-8-15-10-4-2-3-5-11(10)17-12(16-8)9(6-13)7-14-17/h2-5,7H,1H3,(H,15,16)
InChIKey LREZTCPBFLWVCT-UHFFFAOYSA-N
Literature Reference Author N.P.PEET,S.SUNDER,R.J.BARBUCH
Literature Reference Citation J.HETCYCL.CHEM.,20,511(1983)
Literature Reference DOI 10.1002/jhet.5570200304
Molecular Weight 223.237 g/mol
Solvent DMSO-D6
Source File Reference UWED25093