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ETHYL-2-(4,5-DIHYDRO-1H-TETRAZOL-5-YLIDENE)-2-CYANOACETATE-DIAMMONIUM-SALT
SpectraBase Compound ID FGN0wDfKhvL
InChI InChI=1S/C6H7N5O2.2N/c1-2-13-6(12)4(3-7)5-8-10-11-9-5;;/h4-5H,2H2,1H3;;/q;2*+1
InChIKey ZXYKBLJKIICRBI-UHFFFAOYSA-N
Mol Weight 209.169 g/mol
Molecular Formula C6H7N7O2
Exact Mass 209.066122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2IEeee27fsu
Name ETHYL-2-(4,5-DIHYDRO-1H-TETRAZOL-5-YLIDENE)-2-CYANOACETATE-DIAMMONIUM-SALT
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H7N7O2
InChI InChI=1S/C6H7N5O2.2N/c1-2-13-6(12)4(3-7)5-8-10-11-9-5;;/h4-5H,2H2,1H3;;/q;2*+1
InChIKey ZXYKBLJKIICRBI-UHFFFAOYSA-N
Literature Reference Author R.W.SAALFRANK,C.J.LURZ,U.WIRTH,H.G.VONSCHNERING,K.PETERS
Literature Reference Citation J.HETCYCL.CHEM.,28,1863(1991)
Literature Reference DOI 10.1002/jhet.5570280811
Molecular Weight 209.167 g/mol
Solvent ACETONE-D6:CD3OD
Source File Reference UWCP741