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1-[6'-DEOXY-6'-PHOSPHONO-BETA-D-RIBO-(5'S)-HEXAFURANOSYL]-CYTOSINE-DISODIUM-SALT
SpectraBase Compound ID BKlaclMeCuc
InChI InChI=1S/C10H16N3O8P.2Na/c11-5-1-2-13(10(17)12-5)9-7(16)6(15)8(21-9)4(14)3-22(18,19)20;;/h1-2,4,6-9,14-16H,3H2,(H2,11,12,17)(H2,18,19,20);;/q;2*+1/p-2/t4-,6-,7+,8+,9+;;/m0../s1
InChIKey GJJHPZVVJPNGOC-CHJHNYOOSA-L
Mol Weight 381.18830056 g/mol
Molecular Formula C10H14N3Na2O8P
Exact Mass 381.03139 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ma0x8O80wC
Name 1-[6'-DEOXY-6'-PHOSPHONO-BETA-D-RIBO-(5'S)-HEXAFURANOSYL]-CYTOSINE-DISODIUM-SALT
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H14N3Na2O8P
InChI InChI=1S/C10H16N3O8P.2Na/c11-5-1-2-13(10(17)12-5)9-7(16)6(15)8(21-9)4(14)3-22(18,19)20;;/h1-2,4,6-9,14-16H,3H2,(H2,11,12,17)(H2,18,19,20);;/q;2*+1/p-2/t4-,6-,7+,8+,9+;;/m0../s1
InChIKey GJJHPZVVJPNGOC-CHJHNYOOSA-L
Literature Reference Author M.MEURILLON,L.CHALOIN,C.PERIGAUD,S.PEYROTTES
Literature Reference Citation EUR.J.ORG.CHEM.,2011,3794(2011)
Literature Reference DOI 10.1002/ejoc.201100219
Solvent D2O
Source File Reference UWBT21169