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O-(2-URACYLO-3-TRITYLOXYPROPYL)-O-(2-URACYLO-3-ACETOXYPROPYL)PHOSPHORIC ACID, PYRIDINIUM SALT
SpectraBase Compound ID 6UBFKoG7111
InChI InChI=1S/C35H35N4O11P.C5H5N/c1-25(40)47-21-29(38-19-17-31(41)36-33(38)43)23-49-51(45,46)50-24-30(39-20-18-32(42)37-34(39)44)22-48-35(26-11-5-2-6-12-26,27-13-7-3-8-14-27)28-15-9-4-10-16-28;1-2-4-6-5-3-1/h2-20,29-30H,21-24H2,1H3,(H,45,46)(H,36,41,43)(H,37,42,44);1-5H
InChIKey YXYZDJSVQRIHIX-UHFFFAOYSA-N
Mol Weight 797.8 g/mol
Molecular Formula C40H40N5O11P
Exact Mass 797.246194 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JaZ1vA1x8uP
Name O-(2-URACYLO-3-TRITYLOXYPROPYL)-O-(2-URACYLO-3-ACETOXYPROPYL)PHOSPHORIC ACID, PYRIDINIUM SALT
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C40H40N5O11P
InChI InChI=1S/C35H35N4O11P.C5H5N/c1-25(40)47-21-29(38-19-17-31(41)36-33(38)43)23-49-51(45,46)50-24-30(39-20-18-32(42)37-34(39)44)22-48-35(26-11-5-2-6-12-26,27-13-7-3-8-14-27)28-15-9-4-10-16-28;1-2-4-6-5-3-1/h2-20,29-30H,21-24H2,1H3,(H,45,46)(H,36,41,43)(H,37,42,44);1-5H
InChIKey YXYZDJSVQRIHIX-UHFFFAOYSA-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