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3'-O-ACETYLDEOXYTHYMIDINE-5'-(2,4,6-TRIMETHYLBENZOYL)PHOSPHATE
SpectraBase Compound ID r1lK4YYyfZ
InChI InChI=1S/C22H27N2O10P/c1-11-6-12(2)19(13(3)7-11)21(27)34-35(29,30)31-10-17-16(32-15(5)25)8-18(33-17)24-9-14(4)20(26)23-22(24)28/h6-7,9,16-18H,8,10H2,1-5H3,(H,29,30)(H,23,26,28)/t16-,17+,18+/m0/s1
InChIKey XEKUISIFELRGKX-RCCFBDPRSA-N
Mol Weight 510.44 g/mol
Molecular Formula C22H27N2O10P
Exact Mass 510.140332 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8746zAr4ynQ
Name 3'-O-ACETYLDEOXYTHYMIDINE-5'-(2,4,6-TRIMETHYLBENZOYL)PHOSPHATE
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H27N2O10P
InChI InChI=1S/C22H27N2O10P/c1-11-6-12(2)19(13(3)7-11)21(27)34-35(29,30)31-10-17-16(32-15(5)25)8-18(33-17)24-9-14(4)20(26)23-22(24)28/h6-7,9,16-18H,8,10H2,1-5H3,(H,29,30)(H,23,26,28)/t16-,17+,18+/m0/s1
InChIKey XEKUISIFELRGKX-RCCFBDPRSA-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