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3'-O-METHYLTHIO(2-CYANOETHOXY)PHOSPHORYL-2'-DEOXY-N2-ISOBUTANOYLGUANOSINE
SpectraBase Compound ID 1RzA8Cc7nuH
InChI InChI=1S/C18H25N6O7PS/c1-10(2)16(26)22-18-21-15-14(17(27)23-18)20-9-24(15)13-7-11(12(8-25)30-13)31-32(28,33-3)29-6-4-5-19/h9-13,25H,4,6-8H2,1-3H3,(H2,21,22,23,26,27)/t11-,12+,13+,32?/m0/s1
InChIKey UQCHSGLAAQABLU-WMTUBVBNSA-N
Mol Weight 500.47 g/mol
Molecular Formula C18H25N6O7PS
Exact Mass 500.124305 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E3W4CDGbox
Name 3'-O-METHYLTHIO(2-CYANOETHOXY)PHOSPHORYL-2'-DEOXY-N2-ISOBUTANOYLGUANOSINE
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 C18H25N6O7PS
InChI InChI=1S/C18H25N6O7PS/c1-10(2)16(26)22-18-21-15-14(17(27)23-18)20-9-24(15)13-7-11(12(8-25)30-13)31-32(28,33-3)29-6-4-5-19/h9-13,25H,4,6-8H2,1-3H3,(H2,21,22,23,26,27)/t11-,12+,13+,32?/m0/s1
InChIKey UQCHSGLAAQABLU-WMTUBVBNSA-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