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N-(6)-BENZOYL-5'-O-[[BIS-(ALLYLOXY)-PHOSPHINYL]-OXY]-3'-O-[[BIS-(BENZYLOXY)-PHOSPHINYL]-OXY]-2'-O-(4-METHOXYBENZYL)-ADENOSINE
SpectraBase Compound ID I6RX3eH3A8R
InChI InChI=1S/C45H47N5O12P2/c1-4-25-56-63(52,57-26-5-2)60-30-38-40(62-64(53,58-28-33-15-9-6-10-16-33)59-29-34-17-11-7-12-18-34)41(55-27-35-21-23-37(54-3)24-22-35)45(61-38)50-32-48-39-42(46-31-47-43(39)50)49-44(51)36-19-13-8-14-20-36/h4-24,31-32,38,40-41,45H,1-2,25-30H2,3H3,(H,46,47,49,51)/t38-,40-,41-,45-/m0/s1
InChIKey NFWWVFKUMVVDPJ-AYHUOIEDSA-N
Mol Weight 911.8 g/mol
Molecular Formula C45H47N5O12P2
Exact Mass 911.269646 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JdD8AaoNPsu
Name N-(6)-BENZOYL-5'-O-[[BIS-(ALLYLOXY)-PHOSPHINYL]-OXY]-3'-O-[[BIS-(BENZYLOXY)-PHOSPHINYL]-OXY]-2'-O-(4-METHOXYBENZYL)-ADENOSINE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H47N5O12P2
InChI InChI=1S/C45H47N5O12P2/c1-4-25-56-63(52,57-26-5-2)60-30-38-40(62-64(53,58-28-33-15-9-6-10-16-33)59-29-34-17-11-7-12-18-34)41(55-27-35-21-23-37(54-3)24-22-35)45(61-38)50-32-48-39-42(46-31-47-43(39)50)49-44(51)36-19-13-8-14-20-36/h4-24,31-32,38,40-41,45H,1-2,25-30H2,3H3,(H,46,47,49,51)/t38-,40-,41-,45-/m0/s1
InChIKey NFWWVFKUMVVDPJ-AYHUOIEDSA-N
Literature Reference Author J.I.ARMSTRONG,D.E.VERDUGO,C.R.BERTOZZI
Literature Reference Citation J.ORG.CHEM.,68,170(2003)
Literature Reference DOI 10.1021/jo0260443
Solvent CDCl3
Source File Reference UWVN24968