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3,5-Dimethoxy-4-hydroxy-benzoic acid, 3-guanidino-propyl ester cation
SpectraBase Compound ID AvPGuJD23ij
InChI InChI=1S/C13H19N3O5/c1-19-9-6-8(7-10(20-2)11(9)17)12(18)21-5-3-4-16-13(14)15/h6-7,17H,3-5H2,1-2H3,(H4,14,15,16)/p+1
InChIKey FQMPFILPYAJDCZ-UHFFFAOYSA-O
Mol Weight 298.32 g/mol
Molecular Formula C13H20N3O5
Exact Mass 298.140296 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID lYUWmFysHZ
Name 3,5-Dimethoxy-4-hydroxy-benzoic acid, 3-guanidino-propyl ester cation
Comments hydrochloride
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H20N3O5
InChI InChI=1S/C13H19N3O5/c1-19-9-6-8(7-10(20-2)11(9)17)12(18)21-5-3-4-16-13(14)15/h6-7,17H,3-5H2,1-2H3,(H4,14,15,16)/p+1
InChIKey FQMPFILPYAJDCZ-UHFFFAOYSA-O
Instrument Name Varian CFT-20
Literature Reference G.E. Langford, P. Yates, H.W.Yeung, Org. Magn. Resonance 14, 474 (1980).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6