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3'-ACETYLDEOXYTHYMIDINE-5'-CYCLOHEXYLAMIDO(IMIDAZOLIDO)PHOSPHATE(DIASTEREOMER MIXTURE)
SpectraBase Compound ID Dlwcd3tOz1d
InChI InChI=1S/C21H30N5O7P/c1-14-11-26(21(29)23-20(14)28)19-10-17(32-15(2)27)18(33-19)12-31-34(30,25-9-8-22-13-25)24-16-6-4-3-5-7-16/h8-9,11,13,16-19H,3-7,10,12H2,1-2H3,(H,24,30)(H,23,28,29)/t17-,18+,19+,34?/m0/s1
InChIKey PZJMTOHOVNOAQB-JOQRBTQLSA-N
Mol Weight 495.47 g/mol
Molecular Formula C21H30N5O7P
Exact Mass 495.188285 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8syMOnynJNY
Name 3'-ACETYLDEOXYTHYMIDINE-5'-CYCLOHEXYLAMIDO(IMIDAZOLIDO)PHOSPHATE(DIASTEREOMER MIXTURE)
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H30N5O7P
InChI InChI=1S/C21H30N5O7P/c1-14-11-26(21(29)23-20(14)28)19-10-17(32-15(2)27)18(33-19)12-31-34(30,25-9-8-22-13-25)24-16-6-4-3-5-7-16/h8-9,11,13,16-19H,3-7,10,12H2,1-2H3,(H,24,30)(H,23,28,29)/t17-,18+,19+,34?/m0/s1
InChIKey PZJMTOHOVNOAQB-JOQRBTQLSA-N
Instrument Name Bruker HX-90
Literature Reference A.V.LEBEDEV, A.I.REZVUKHIN (1983) Bioorganich.Khim.(Russ. Lang.): v.9, N2, 149-185.
NMR Standard -H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C5H5N pyridine