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DEOXYADENOSINE-3'-2-CHLOROPHENYL(ANILIDO)PHOSPHATE (DIASTEREOMERMIXTURE)
SpectraBase Compound ID 5prY9kJTIUL
InChI InChI=1S/C22H22ClN6O5P/c23-15-8-4-5-9-16(15)33-35(31,28-14-6-2-1-3-7-14)34-17-10-19(32-18(17)11-30)29-13-27-20-21(24)25-12-26-22(20)29/h1-9,12-13,17-19,30H,10-11H2,(H,28,31)(H2,24,25,26)/t17-,18+,19+,35?/m0/s1
InChIKey XPVMMGRROQJKJT-AXOPYWAMSA-N
Mol Weight 516.88 g/mol
Molecular Formula C22H22ClN6O5P
Exact Mass 516.107783 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JulcpPLOMzH
Name DEOXYADENOSINE-3'-2-CHLOROPHENYL(ANILIDO)PHOSPHATE (DIASTEREOMERMIXTURE)
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H22ClN6O5P
InChI InChI=1S/C22H22ClN6O5P/c23-15-8-4-5-9-16(15)33-35(31,28-14-6-2-1-3-7-14)34-17-10-19(32-18(17)11-30)29-13-27-20-21(24)25-12-26-22(20)29/h1-9,12-13,17-19,30H,10-11H2,(H,28,31)(H2,24,25,26)/t17-,18+,19+,35?/m0/s1
InChIKey XPVMMGRROQJKJT-AXOPYWAMSA-N
Instrument Name Bruker HX-90
Literature Reference A.V.LEBEDEV, A.I.REZVUKHIN (REVIEW) (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