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BIS(3'-O-ACETYLDEOXYTHYMIDIN-5'-YL)PARA-CHLOROPHENYLPYROPHOSPHATE
SpectraBase Compound ID 8pmHx1xmmCx
InChI InChI=1S/C30H35ClN4O17P2/c1-15-11-34(29(40)32-27(15)38)25-9-21(47-17(3)36)23(49-25)13-45-53(42,43)52-54(44,51-20-7-5-19(31)6-8-20)46-14-24-22(48-18(4)37)10-26(50-24)35-12-16(2)28(39)33-30(35)41/h5-8,11-12,21-26H,9-10,13-14H2,1-4H3,(H,42,43)(H,32,38,40)(H,33,39,41)/t21-,22-,23+,24+,25+,26+,54?/m0/s1
InChIKey VCCWLQGNDULFBO-CLNNYEBKSA-N
Mol Weight 821.0 g/mol
Molecular Formula C30H35ClN4O17P2
Exact Mass 820.116097 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4lH6hptPSwx
Name BIS(3'-O-ACETYLDEOXYTHYMIDIN-5'-YL)PARA-CHLOROPHENYLPYROPHOSPHATE
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C30H35ClN4O17P2
InChI InChI=1S/C30H35ClN4O17P2/c1-15-11-34(29(40)32-27(15)38)25-9-21(47-17(3)36)23(49-25)13-45-53(42,43)52-54(44,51-20-7-5-19(31)6-8-20)46-14-24-22(48-18(4)37)10-26(50-24)35-12-16(2)28(39)33-30(35)41/h5-8,11-12,21-26H,9-10,13-14H2,1-4H3,(H,42,43)(H,32,38,40)(H,33,39,41)/t21-,22-,23+,24+,25+,26+,54?/m0/s1
InChIKey VCCWLQGNDULFBO-CLNNYEBKSA-N
Instrument Name Bruker HX-90
Literature Reference A.V.LEBEDEV, A.I.REZVUKHIN (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