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5'-DIMETHOXYTRITYL-N-BENZOYLDEOXYCYTIDINE-3'-O,N,N-TRIMETHYLAMIDOPHOSPHITE (ISOMER MIXTURE)
SpectraBase Compound ID 4ILHum1yQkE
InChI InChI=1S/C40H43N4O8P/c1-43(2)53(49-5)52-34-26-37(44-25-24-36(42-39(44)46)41-38(45)28-12-8-6-9-13-28)51-35(34)27-50-40(29-14-10-7-11-15-29,30-16-20-32(47-3)21-17-30)31-18-22-33(48-4)23-19-31/h6-25,34-35,37H,26-27H2,1-5H3,(H,41,42,45,46)/t34-,35+,37+,53?/m0/s1
InChIKey DDQWRZPQATWBGR-NYPUCURUSA-N
Mol Weight 738.8 g/mol
Molecular Formula C40H43N4O8P
Exact Mass 738.281851 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LxZ6NeyvjbV
Name 5'-DIMETHOXYTRITYL-N-BENZOYLDEOXYCYTIDINE-3'-O,N,N-TRIMETHYLAMIDOPHOSPHITE (ISOMER 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 C40H43N4O8P
InChI InChI=1S/C40H43N4O8P/c1-43(2)53(49-5)52-34-26-37(44-25-24-36(42-39(44)46)41-38(45)28-12-8-6-9-13-28)51-35(34)27-50-40(29-14-10-7-11-15-29,30-16-20-32(47-3)21-17-30)31-18-22-33(48-4)23-19-31/h6-25,34-35,37H,26-27H2,1-5H3,(H,41,42,45,46)/t34-,35+,37+,53?/m0/s1
InChIKey DDQWRZPQATWBGR-NYPUCURUSA-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 C3D6O acetone-d6