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6-Methyl-isopterin cation

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6-Methyl-isopterin cation
SpectraBase Compound ID 3SW7cHebHEH
InChI InChI=1S/C7H7N5O/c1-3-2-9-6-4(10-3)5(8)11-7(13)12-6/h2H,1H3,(H3,8,9,11,12,13)/p+1
InChIKey XSYFTQXDJHQAHC-UHFFFAOYSA-O
Mol Weight 178.18 g/mol
Molecular Formula C7H8N5O
Exact Mass 178.072885 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID l3XwnV5dex
Name 6-Methyl-isopterin cation
Comments TRIFLUOROACETATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H8N5O
InChI InChI=1S/C7H7N5O/c1-3-2-9-6-4(10-3)5(8)11-7(13)12-6/h2H,1H3,(H3,8,9,11,12,13)/p+1
InChIKey XSYFTQXDJHQAHC-UHFFFAOYSA-O
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 CF3COOH