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3'-O-METHYLTHIO(2-CYANOETHOXY)PHOSPHORYLTHYMIDINE
SpectraBase Compound ID 2A81YOV6N0U
InChI InChI=1S/C14H20N3O7PS/c1-9-7-17(14(20)16-13(9)19)12-6-10(11(8-18)23-12)24-25(21,26-2)22-5-3-4-15/h7,10-12,18H,3,5-6,8H2,1-2H3,(H,16,19,20)/t10-,11+,12+,25?/m0/s1
InChIKey FLVPAHTYXVXAOL-DXUXQDKCSA-N
Mol Weight 405.36 g/mol
Molecular Formula C14H20N3O7PS
Exact Mass 405.075958 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3sUfrDf7HV
Name 3'-O-METHYLTHIO(2-CYANOETHOXY)PHOSPHORYLTHYMIDINE
Comments , TWO-DIASTEREOMER MIDDLE VALUE OF CHEMICAL SHIFT. NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H20N3O7PS
InChI InChI=1S/C14H20N3O7PS/c1-9-7-17(14(20)16-13(9)19)12-6-10(11(8-18)23-12)24-25(21,26-2)22-5-3-4-15/h7,10-12,18H,3,5-6,8H2,1-2H3,(H,16,19,20)/t10-,11+,12+,25?/m0/s1
InChIKey FLVPAHTYXVXAOL-DXUXQDKCSA-N
Instrument Name Bruker HX-90
Literature Reference V.P.KUMAREV, L.V.BARANOVA, V.S.BOGACHEV, A.V.LEBEDEV, L.V.OBUKHOVA (1986)Bioorganich.Khim.(Russ. Lang.): v.12, N10, 1348-1358.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported