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BIS(N-ANISOYLDEOXYCYTIDIN-5'-YL)CYANOETHYLPYROPHOSPHATE
SpectraBase Compound ID AJuQiDiLmjx
InChI InChI=1S/C37H41N7O17P2/c1-54-24-8-4-22(5-9-24)34(47)39-30-12-15-43(36(49)41-30)32-18-26(45)28(59-32)20-57-62(51,52)61-63(53,56-17-3-14-38)58-21-29-27(46)19-33(60-29)44-16-13-31(42-37(44)50)40-35(48)23-6-10-25(55-2)11-7-23/h4-13,15-16,26-29,32-33,45-46H,3,17-21H2,1-2H3,(H,51,52)(H,39,41,47,49)(H,40,42,48,50)/t26-,27-,28+,29+,32+,33+,63?/m0/s1
InChIKey FVVODINWTASTLW-UCQNEOIZSA-N
Mol Weight 917.7 g/mol
Molecular Formula C37H41N7O17P2
Exact Mass 917.203417 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 68fbtF3z6Do
Name BIS(N-ANISOYLDEOXYCYTIDIN-5'-YL)CYANOETHYLPYROPHOSPHATE
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C37H41N7O17P2
InChI InChI=1S/C37H41N7O17P2/c1-54-24-8-4-22(5-9-24)34(47)39-30-12-15-43(36(49)41-30)32-18-26(45)28(59-32)20-57-62(51,52)61-63(53,56-17-3-14-38)58-21-29-27(46)19-33(60-29)44-16-13-31(42-37(44)50)40-35(48)23-6-10-25(55-2)11-7-23/h4-13,15-16,26-29,32-33,45-46H,3,17-21H2,1-2H3,(H,51,52)(H,39,41,47,49)(H,40,42,48,50)/t26-,27-,28+,29+,32+,33+,63?/m0/s1
InChIKey FVVODINWTASTLW-UCQNEOIZSA-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