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#12B;2'-(2-CYANOETHYL)-[1'-(2-(N6-(PARA-METHOXYBENZOYL)-ADENIN-1-YL)-ACETAMINO)-3'-(9-PHENYL-XANTHEN-9-YLOXY)-CYCLOPENTYL]-N,N-DIISOPROPYLPHOSPHORAMIDITE
SpectraBase Compound ID A3P8xjTz8cO
InChI InChI=1S/2C48H51N8O6P/c2*1-31(2)56(32(3)4)63(27-13-26-49)62-41-25-24-40(61-48(34-14-7-6-8-15-34)36-16-9-11-18-38(36)60-39-19-12-10-17-37(39)48)43(41)53-42(57)28-55-30-52-44-45(50-29-51-46(44)55)54-47(58)33-20-22-35(59-5)23-21-33/h2*6-12,14-23,29-32,40-41,43H,13,24-25,27-28H2,1-5H3,(H,53,57)(H,50,51,54,58)/t2*40-,41-,43+,63?/m00/s1
InChIKey FQZDTDGELMKXFX-DKTSXQSCSA-N
Mol Weight 1733.9 g/mol
Molecular Formula C96H102N16O12P2
Exact Mass 1732.733837 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5flbXKs1OaK
Name #12B;2'-(2-CYANOETHYL)-[1'-(2-(N6-(PARA-METHOXYBENZOYL)-ADENIN-1-YL)-ACETAMINO)-3'-(9-PHENYL-XANTHEN-9-YLOXY)-CYCLOPENTYL]-N,N-DIISOPROPYLPHOSPHORAMIDITE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C96H102N16O12P2
InChI InChI=1S/2C48H51N8O6P/c2*1-31(2)56(32(3)4)63(27-13-26-49)62-41-25-24-40(61-48(34-14-7-6-8-15-34)36-16-9-11-18-38(36)60-39-19-12-10-17-37(39)48)43(41)53-42(57)28-55-30-52-44-45(50-29-51-46(44)55)54-47(58)33-20-22-35(59-5)23-21-33/h2*6-12,14-23,29-32,40-41,43H,13,24-25,27-28H2,1-5H3,(H,53,57)(H,50,51,54,58)/t2*40-,41-,43+,63?/m00/s1
InChIKey FQZDTDGELMKXFX-DKTSXQSCSA-N
Literature Reference Author D.R.AHN,M.MOSIMANN,C.J.LEUMANN
Literature Reference Citation J.ORG.CHEM.,68,7693(2003)
Literature Reference DOI 10.1021/jo034143q
Molecular Weight 1733.913 g/mol
Solvent C6D6
Source File Reference UWLU27399