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N-(6)-BENZOYL-5'-O-(1-METHOXY-1-METHYLETHYL)-2'-DEOXY-ADENOSINE-3'-(2-CYANOETHYL-N,N-DIISOPROPYL)-PHOSPHOR-AMIDITE
SpectraBase Compound ID 4e6ILt72hbW
InChI InChI=1S/2C30H42N7O6P/c2*1-20(2)37(21(3)4)44(41-15-11-14-31)43-23-16-25(42-24(23)17-40-30(5,6)39-7)36-19-34-26-27(32-18-33-28(26)36)35-29(38)22-12-9-8-10-13-22/h2*8-10,12-13,18-21,23-25H,11,15-17H2,1-7H3,(H,32,33,35,38)/t2*23-,24+,25+,44?/m00/s1
InChIKey DVBCVRHQAWROLW-UZUPPVDRSA-N
Mol Weight 1255.4 g/mol
Molecular Formula C60H84N14O12P2
Exact Mass 1254.586838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FmZvZOr3DO2
Name N-(6)-BENZOYL-5'-O-(1-METHOXY-1-METHYLETHYL)-2'-DEOXY-ADENOSINE-3'-(2-CYANOETHYL-N,N-DIISOPROPYL)-PHOSPHOR-AMIDITE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H84N14O12P2
InChI InChI=1S/2C30H42N7O6P/c2*1-20(2)37(21(3)4)44(41-15-11-14-31)43-23-16-25(42-24(23)17-40-30(5,6)39-7)36-19-34-26-27(32-18-33-28(26)36)35-29(38)22-12-9-8-10-13-22/h2*8-10,12-13,18-21,23-25H,11,15-17H2,1-7H3,(H,32,33,35,38)/t2*23-,24+,25+,44?/m00/s1
InChIKey DVBCVRHQAWROLW-UZUPPVDRSA-N
Literature Reference Author A.G.MOLINA,V.KUNGURTSEV,P.VIRTA,H.LOENNBERG
Literature Reference Citation MOLECULES,17,12102(2012)
Literature Reference DOI 10.3390/molecules171012102
Molecular Weight 1255.361 g/mol
Sample ID 1540
Solvent CDCl3