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1-[2-O-ACETYL-4-C-(BENZOYLOXYMETHYL)-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-XYLOFURANOSYL]-THYMINE
SpectraBase Compound ID IPbaPWOgYwZ
InChI InChI=1S/C41H40N2O10/c1-27-23-43(26-42-37(27)46)38-35(52-28(2)44)36(45)40(53-38,24-50-39(47)29-11-7-5-8-12-29)25-51-41(30-13-9-6-10-14-30,31-15-19-33(48-3)20-16-31)32-17-21-34(49-4)22-18-32/h5-23,26,35-36,38,45H,24-25H2,1-4H3/t35-,36-,38-,40-/m0/s1
InChIKey QJRGNNDQFACRDZ-IJLZXJCXSA-N
Mol Weight 720.8 g/mol
Molecular Formula C41H40N2O10
Exact Mass 720.268295 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CQEGRmovR7N
Name 1-[2-O-ACETYL-4-C-(BENZOYLOXYMETHYL)-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-XYLOFURANOSYL]-THYMINE
Compound Number 50 A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H40N2O10
InChI InChI=1S/C41H40N2O10/c1-27-23-43(26-42-37(27)46)38-35(52-28(2)44)36(45)40(53-38,24-50-39(47)29-11-7-5-8-12-29)25-51-41(30-13-9-6-10-14-30,31-15-19-33(48-3)20-16-31)32-17-21-34(49-4)22-18-32/h5-23,26,35-36,38,45H,24-25H2,1-4H3/t35-,36-,38-,40-/m0/s1
InChIKey QJRGNNDQFACRDZ-IJLZXJCXSA-N
Literature Reference Author B.R.BABU,RAUNAK,N.E.POOPEIKO,M.JUHL,A.D.BOND,V.S.PARMAR,J.WE NGEL
Literature Reference Citation EUR.J.ORG.CHEM.,2297(2005)
Literature Reference DOI 10.1002/ejoc.200500023
Molecular Weight 720.776 g/mol
Sample ID 39336
Solvent CDCl3