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3'-O-ACETYLDEOXYTHYMIDINE, 5'-BIS(CYANOETHYL)PHOSPHATE
SpectraBase Compound ID vwegiljMIm
InChI InChI=1S/C18H23N4O9P/c1-12-10-22(18(25)21-17(12)24)16-9-14(30-13(2)23)15(31-16)11-29-32(26,27-7-3-5-19)28-8-4-6-20/h10,14-16H,3-4,7-9,11H2,1-2H3,(H,21,24,25)/t14-,15+,16+/m0/s1
InChIKey RHWXTXOIXXCESQ-ARFHVFGLSA-N
Mol Weight 470.37 g/mol
Molecular Formula C18H23N4O9P
Exact Mass 470.120265 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BJ4nU5wpszI
Name 3'-O-ACETYLDEOXYTHYMIDINE, 5'-BIS(CYANOETHYL)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 C18H23N4O9P
InChI InChI=1S/C18H23N4O9P/c1-12-10-22(18(25)21-17(12)24)16-9-14(30-13(2)23)15(31-16)11-29-32(26,27-7-3-5-19)28-8-4-6-20/h10,14-16H,3-4,7-9,11H2,1-2H3,(H,21,24,25)/t14-,15+,16+/m0/s1
InChIKey RHWXTXOIXXCESQ-ARFHVFGLSA-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