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N/6/-((2-Carboxyethyl)thiomethyl)-9-methyl-adenine

View entire compound with spectra: 1 NMR

N/6/-((2-Carboxyethyl)thiomethyl)-9-methyl-adenine
SpectraBase Compound ID 1QJtXsiIQRC
InChI InChI=1S/C10H13N5O2S/c1-15-5-13-8-9(11-4-12-10(8)15)14-6-18-3-2-7(16)17/h4-5H,2-3,6H2,1H3,(H,16,17)(H,11,12,14)
InChIKey LVYKOHGCKCBNPC-UHFFFAOYSA-N
Mol Weight 267.31 g/mol
Molecular Formula C10H13N5O2S
Exact Mass 267.078996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I6yjLjZaWqH
Name N/6/-((2-Carboxyethyl)thiomethyl)-9-methyl-adenine
CAS Registry Number 69565-83-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H13N5O2S
InChI InChI=1S/C10H13N5O2S/c1-15-5-13-8-9(11-4-12-10(8)15)14-6-18-3-2-7(16)17/h4-5H,2-3,6H2,1H3,(H,16,17)(H,11,12,14)
InChIKey LVYKOHGCKCBNPC-UHFFFAOYSA-N
Literature Reference Y. Yamazaki, H. Suzuki, Eur. J. Biochem. 92, 197 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported