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3'-Amino-3'-deoxyadenosine-5'-thionophosphate P-nitrophenyl ester

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3'-Amino-3'-deoxyadenosine-5'-thionophosphate P-nitrophenyl ester
SpectraBase Compound ID If4QhhR09G0
InChI InChI=1S/C16H18N7O7PS/c17-11-10(5-28-31(27,32)30-9-3-1-8(2-4-9)23(25)26)29-16(13(11)24)22-7-21-12-14(18)19-6-20-15(12)22/h1-4,6-7,10-11,13,16,24H,5,17H2,(H,27,32)(H2,18,19,20)/p-1
InChIKey CHDWOXMGDZGCIF-UHFFFAOYSA-M
Mol Weight 482.39 g/mol
Molecular Formula C16H17N7O7PS
Exact Mass 482.064779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CNoTpl2zMmG
Name 3'-Amino-3'-deoxyadenosine-5'-thionophosphate P-nitrophenyl ester
Comments SHIFTS FOR C-6,10,12,16 ARE AVERAGES FOR TWO PHOSPHORUS DIASTEREO- MERS
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H17N7O7PS
InChI InChI=1S/C16H18N7O7PS/c17-11-10(5-28-31(27,32)30-9-3-1-8(2-4-9)23(25)26)29-16(13(11)24)22-7-21-12-14(18)19-6-20-15(12)22/h1-4,6-7,10-11,13,16,24H,5,17H2,(H,27,32)(H2,18,19,20)/p-1
InChIKey CHDWOXMGDZGCIF-UHFFFAOYSA-M
Instrument Name Varian CFT-20
Literature Reference M. Morr, L. Ernst, Chem. Ber. 111, 2152 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O