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#6D;(S)-N-ACETYL-2-PYRROLIDINYLMETHYL-5'-O-(PARA,PARA'-DIMETHOXYTRITYL)-THYMIDIN-3'-YL-3'-O-(TERT.-BUTYLDIMETHYLSILYL)-THYMIDIN-5'-YL-(S)-PHOSPHOROTHIOATE
SpectraBase Compound ID EkveMPPvo6D
InChI InChI=1S/C54H70N5O14PSSi/c1-34-29-58(51(63)55-49(34)61)47-27-43(45(70-47)32-67-54(37-15-12-11-13-16-37,38-18-22-41(65-7)23-19-38)39-20-24-42(66-8)25-21-39)72-74(75,68-31-40-17-14-26-57(40)36(3)60)69-33-46-44(73-76(9,10)53(4,5)6)28-48(71-46)59-30-35(2)50(62)56-52(59)64/h11-13,15-16,18-25,29-30,40,43-48H,14,17,26-28,31-33H2,1-10H3,(H,55,61,63)(H,56,62,64)/t40-,43-,44-,45+,46+,47+,48+,74?/m0/s1
InChIKey QIRLUDMYVBJKNA-BIJSEQTQSA-N
Mol Weight 1104.3 g/mol
Molecular Formula C54H70N5O14PSSi
Exact Mass 1103.414687 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JTGKiMJAeAT
Name #6D;(S)-N-ACETYL-2-PYRROLIDINYLMETHYL-5'-O-(PARA,PARA'-DIMETHOXYTRITYL)-THYMIDIN-3'-YL-3'-O-(TERT.-BUTYLDIMETHYLSILYL)-THYMIDIN-5'-YL-(S)-PHOSPHOROTHIOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H70N5O14PSSi
InChI InChI=1S/C54H70N5O14PSSi/c1-34-29-58(51(63)55-49(34)61)47-27-43(45(70-47)32-67-54(37-15-12-11-13-16-37,38-18-22-41(65-7)23-19-38)39-20-24-42(66-8)25-21-39)72-74(75,68-31-40-17-14-26-57(40)36(3)60)69-33-46-44(73-76(9,10)53(4,5)6)28-48(71-46)59-30-35(2)50(62)56-52(59)64/h11-13,15-16,18-25,29-30,40,43-48H,14,17,26-28,31-33H2,1-10H3,(H,55,61,63)(H,56,62,64)/t40-,43-,44-,45+,46+,47+,48+,74?/m0/s1
InChIKey QIRLUDMYVBJKNA-BIJSEQTQSA-N
Literature Reference Author M.HYODO,H.ANDO,H.NISHITANI,A.HATTORI,H.HAYAKAWA,M.KATAOKA,Y. HAYAKAWA
Literature Reference Citation EUR.J.ORG.CHEM.,5216(2005)
Solvent Unknown
Source File Reference UWLU42669