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N/6/,N/6/-Bis((2-carboxyethyl)thiomethyl)-9-methyl-adenine

View entire compound with spectra: 1 NMR

N/6/,N/6/-Bis((2-carboxyethyl)thiomethyl)-9-methyl-adenine
SpectraBase Compound ID 5MwjIuvUkEx
InChI InChI=1S/C14H19N5O4S2/c1-18-7-17-12-13(18)15-6-16-14(12)19(8-24-4-2-10(20)21)9-25-5-3-11(22)23/h6-7H,2-5,8-9H2,1H3,(H,20,21)(H,22,23)
InChIKey PFNIKJRYDNPFJX-UHFFFAOYSA-N
Mol Weight 385.46 g/mol
Molecular Formula C14H19N5O4S2
Exact Mass 385.087846 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GMxLq1YWlCx
Name N/6/,N/6/-Bis((2-carboxyethyl)thiomethyl)-9-methyl-adenine
CAS Registry Number 69565-84-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H19N5O4S2
InChI InChI=1S/C14H19N5O4S2/c1-18-7-17-12-13(18)15-6-16-14(12)19(8-24-4-2-10(20)21)9-25-5-3-11(22)23/h6-7H,2-5,8-9H2,1H3,(H,20,21)(H,22,23)
InChIKey PFNIKJRYDNPFJX-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