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Isopterin dication

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Isopterin dication
SpectraBase Compound ID I9GvLshprO5
InChI InChI=1S/C6H5N5O/c7-4-3-5(9-2-1-8-3)11-6(12)10-4/h1-2H,(H3,7,9,10,11,12)/p+2
InChIKey ZYLMCRLXTUAWGM-UHFFFAOYSA-P
Mol Weight 165.16 g/mol
Molecular Formula C6H7N5O
Exact Mass 165.06506 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H2BvdDxNBaq
Name Isopterin dication
Comments FLUOROSULFATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H7N5O
InChI InChI=1S/C6H5N5O/c7-4-3-5(9-2-1-8-3)11-6(12)10-4/h1-2H,(H3,7,9,10,11,12)/p+2
InChIKey ZYLMCRLXTUAWGM-UHFFFAOYSA-P
Instrument Name Bruker WH-400
Literature Reference S. Tobias, H. Guenther, W. Pfleiderer, Chem. Ber. 118, 354 (1985).
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent HSO3F