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Tetraacetyl-3-methyl-7-desmethyl-1,5-dihydro-riboflavin

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Tetraacetyl-3-methyl-7-desmethyl-1,5-dihydro-riboflavin
SpectraBase Compound ID 45QASdEg8Sy
InChI InChI=1S/C25H30N4O10/c1-12-7-8-18-17(9-12)26-21-23(27-25(35)28(6)24(21)34)29(18)10-19(37-14(3)31)22(39-16(5)33)20(38-15(4)32)11-36-13(2)30/h7-9,19-20,22,26H,10-11H2,1-6H3,(H,27,35)
InChIKey GBZWUZBMWUPJKI-UHFFFAOYSA-N
Mol Weight 546.53 g/mol
Molecular Formula C25H30N4O10
Exact Mass 546.196193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HyDSu8y0MIT
Name Tetraacetyl-3-methyl-7-desmethyl-1,5-dihydro-riboflavin
CAS Registry Number 77008-51-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H30N4O10
InChI InChI=1S/C25H30N4O10/c1-12-7-8-18-17(9-12)26-21-23(27-25(35)28(6)24(21)34)29(18)10-19(37-14(3)31)22(39-16(5)33)20(38-15(4)32)11-36-13(2)30/h7-9,19-20,22,26H,10-11H2,1-6H3,(H,27,35)
InChIKey GBZWUZBMWUPJKI-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference C.G. Van Schagen, F. Mueller, Helv. Chim. Acta 63, 2187 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3