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N(6)-BENZOYL-9-(2'-ACETYL-3'-ACETYLOXYMETHYL-6'-TERT.-BUTYLDIPHENYLSILYL-3',5'-DIDEOXY-BETA-ALLO-FURANOSYL)-ADENINE
SpectraBase Compound ID 27BlMZWDP4g
InChI InChI=1S/C39H43N5O7Si/c1-26(45)48-23-31-32(21-22-49-52(39(3,4)5,29-17-11-7-12-18-29)30-19-13-8-14-20-30)51-38(34(31)50-27(2)46)44-25-42-33-35(40-24-41-36(33)44)43-37(47)28-15-9-6-10-16-28/h6-20,24-25,31-32,34,38H,21-23H2,1-5H3,(H,40,41,43,47)/t31-,32-,34-,38-/m0/s1
InChIKey JOKZAEAXCJPLMA-UVHRDVFNSA-N
Mol Weight 721.9 g/mol
Molecular Formula C39H43N5O7Si
Exact Mass 721.293175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JiDpi4G0Y6S
Name N(6)-BENZOYL-9-(2'-ACETYL-3'-ACETYLOXYMETHYL-6'-TERT.-BUTYLDIPHENYLSILYL-3',5'-DIDEOXY-BETA-ALLO-FURANOSYL)-ADENINE
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H43N5O7Si
InChI InChI=1S/C39H43N5O7Si/c1-26(45)48-23-31-32(21-22-49-52(39(3,4)5,29-17-11-7-12-18-29)30-19-13-8-14-20-30)51-38(34(31)50-27(2)46)44-25-42-33-35(40-24-41-36(33)44)43-37(47)28-15-9-6-10-16-28/h6-20,24-25,31-32,34,38H,21-23H2,1-5H3,(H,40,41,43,47)/t31-,32-,34-,38-/m0/s1
InChIKey JOKZAEAXCJPLMA-UVHRDVFNSA-N
Literature Reference Author C.RICHERT,A.L.ROUGHTON,S.A.BENNER
Literature Reference Citation J.AM.CHEM.SOC.,118,4518(1996)
Literature Reference DOI 10.1021/ja952322m
Molecular Weight 721.885 g/mol
Sample ID 57080
Solvent CDCl3