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2',3',5'-TRI-O-ACETYLADENOSINE-6-N-[O,O-DIETHYL-PHOSPHOROTHIOAMIDATE]
SpectraBase Compound ID 3F6N7M6jVuT
InChI InChI=1S/C20H28N5O9PS/c1-6-30-35(36,31-7-2)24-18-15-19(22-9-21-18)25(10-23-15)20-17(33-13(5)28)16(32-12(4)27)14(34-20)8-29-11(3)26/h9-10,14,16-17,20H,6-8H2,1-5H3,(H,21,22,24,36)/t14-,16?,17-,20-/m0/s1
InChIKey ZXWQYANSELCKKM-VVEKBEKVSA-N
Mol Weight 545.5 g/mol
Molecular Formula C20H28N5O9PS
Exact Mass 545.134536 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9u5KkPF9o6R
Name 2',3',5'-TRI-O-ACETYLADENOSINE-6-N-[O,O-DIETHYL-PHOSPHOROTHIOAMIDATE]
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28N5O9PS
InChI InChI=1S/C20H28N5O9PS/c1-6-30-35(36,31-7-2)24-18-15-19(22-9-21-18)25(10-23-15)20-17(33-13(5)28)16(32-12(4)27)14(34-20)8-29-11(3)26/h9-10,14,16-17,20H,6-8H2,1-5H3,(H,21,22,24,36)/t14-,16?,17-,20-/m0/s1
InChIKey ZXWQYANSELCKKM-VVEKBEKVSA-N
Literature Reference Author T.WADA,T.MORIGUCHI,M.SEKINE
Literature Reference Citation J.AM.CHEM.SOC.,116,9901(1994)
Literature Reference DOI 10.1021/ja00101a011
Solvent CDCl3
Source File Reference UWSI786