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N-ANISOYLDEOXYCYTIDINE-5'-BIS(CYANOETHYL)PHOSPHATE
SpectraBase Compound ID GteE6zKSDw5
InChI InChI=1S/C23H26N5O9P/c1-33-17-6-4-16(5-7-17)22(30)26-20-8-11-28(23(31)27-20)21-14-18(29)19(37-21)15-36-38(32,34-12-2-9-24)35-13-3-10-25/h4-8,11,18-19,21,29H,2-3,12-15H2,1H3,(H,26,27,30,31)/t18-,19+,21+/m0/s1
InChIKey XBVSTECJMHMDFT-QKNQBKEWSA-N
Mol Weight 547.46 g/mol
Molecular Formula C23H26N5O9P
Exact Mass 547.146814 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BWvOf4KmWii
Name N-ANISOYLDEOXYCYTIDINE-5'-BIS(CYANOETHYL)PHOSPHATE
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H26N5O9P
InChI InChI=1S/C23H26N5O9P/c1-33-17-6-4-16(5-7-17)22(30)26-20-8-11-28(23(31)27-20)21-14-18(29)19(37-21)15-36-38(32,34-12-2-9-24)35-13-3-10-25/h4-8,11,18-19,21,29H,2-3,12-15H2,1H3,(H,26,27,30,31)/t18-,19+,21+/m0/s1
InChIKey XBVSTECJMHMDFT-QKNQBKEWSA-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