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2-Methylthio-inosine

View entire compound with spectra: 1 NMR

2-Methylthio-inosine
SpectraBase Compound ID C1xlyZF6k9u
InChI InChI=1S/C11H14N4O5S/c1-21-11-13-8-5(9(19)14-11)12-3-15(8)10-7(18)6(17)4(2-16)20-10/h3-4,6-7,10,16-18H,2H2,1H3,(H,13,14,19)
InChIKey UKKPPYZMRPWXAX-UHFFFAOYSA-N
Mol Weight 314.32 g/mol
Molecular Formula C11H14N4O5S
Exact Mass 314.068491 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I9AKOVxhHvc
Name 2-Methylthio-inosine
CAS Registry Number 14675-53-7
Comments HITACHI R-22
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H14N4O5S
InChI InChI=1S/C11H14N4O5S/c1-21-11-13-8-5(9(19)14-11)12-3-15(8)10-7(18)6(17)4(2-16)20-10/h3-4,6-7,10,16-18H,2H2,1H3,(H,13,14,19)
InChIKey UKKPPYZMRPWXAX-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference S. Uesugi, M. Ikehara, J. Am. Chem. Soc. 99, 3250 (1977).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6