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5'-O-BIS(CYANOETHOXY)PHOSPHORYL-N-BENZOYLADENOSINE
SpectraBase Compound ID 52HRIA2albj
InChI InChI=1S/C23H24N7O7P/c24-8-4-10-34-38(33,35-11-5-9-25)36-13-18-17(31)12-19(37-18)30-15-28-20-21(26-14-27-22(20)30)29-23(32)16-6-2-1-3-7-16/h1-3,6-7,14-15,17-19,31H,4-5,10-13H2,(H,26,27,29,32)/t17-,18+,19+/m0/s1
InChIKey FQUYVNKVEQHQMF-IPMKNSEASA-N
Mol Weight 541.46 g/mol
Molecular Formula C23H24N7O7P
Exact Mass 541.147483 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FH3ZSk9eZOI
Name 5'-O-BIS(CYANOETHOXY)PHOSPHORYL-N-BENZOYLADENOSINE
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H24N7O7P
InChI InChI=1S/C23H24N7O7P/c24-8-4-10-34-38(33,35-11-5-9-25)36-13-18-17(31)12-19(37-18)30-15-28-20-21(26-14-27-22(20)30)29-23(32)16-6-2-1-3-7-16/h1-3,6-7,14-15,17-19,31H,4-5,10-13H2,(H,26,27,29,32)/t17-,18+,19+/m0/s1
InChIKey FQUYVNKVEQHQMF-IPMKNSEASA-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