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7-AMINO-4-CYANO-IMIDAZO-[5.1-D]-[1.2.3.5]-TETRAZEPINE
SpectraBase Compound ID 4wFaJhruwgv
InChI InChI=1S/C7H3N8.K/c8-1-4-6(10)15-3-11-5(2-9)7(15)13-14-12-4;/h3H,10H2;/q-1;+1
InChIKey XGMRELDXXCMZOE-UHFFFAOYSA-N
Mol Weight 238.26 g/mol
Molecular Formula C7H3KN8
Exact Mass 238.011774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FatXJfIoZKv
Name 7-AMINO-4-CYANO-IMIDAZO-[5.1-D]-[1.2.3.5]-TETRAZEPINE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H3KN8
InChI InChI=1S/C7H3N8.K/c8-1-4-6(10)15-3-11-5(2-9)7(15)13-14-12-4;/h3H,10H2;/q-1;+1
InChIKey XGMRELDXXCMZOE-UHFFFAOYSA-N
Literature Reference Author A.P.FREITAS,M.F.J.R.P.PROENCA,B.L.BOOTH
Literature Reference Citation J.HETCYCL.CHEM.,32,457(1995)
Literature Reference DOI 10.1002/jhet.5570320212
Molecular Weight 238.253 g/mol
Solvent DMSO-D6
Source File Reference UWMK268