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#2A;(2S,8S)-8-(TERT.-BUTYLDIPHENYLSILANYLOXYMETHYL)-2-(2-1,4,7,10,13)-PENTAOXA-16-AZACYCLOOCTADEC-16-YL-ACETOXYMETHYL)-3,4,6,7,8,9-HEXAHYDRO-2H-PYRIMIDO-[1,2-A
SpectraBase Compound ID HQXpsNWvUkO
InChI InChI=1S/C39H60N4O8Si.F6P/c1-39(2,3)52(35-10-6-4-7-11-35,36-12-8-5-9-13-36)51-32-34-15-17-43-16-14-33(40-38(43)41-34)31-50-37(44)30-42-18-20-45-22-24-47-26-28-49-29-27-48-25-23-46-21-19-42;1-7(2,3,4,5)6/h4-13,33-34H,14-32H2,1-3H3,(H,40,41);/q;-1/p+1/t33-,34-;/m0./s1
InChIKey ZYLKVEGBOQBIRR-GFLYYBHISA-O
Mol Weight 887.0 g/mol
Molecular Formula C39H61F6N4O8PSi
Exact Mass 886.390047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3wfsFOgf3CC
Name #2A;(2S,8S)-8-(TERT.-BUTYLDIPHENYLSILANYLOXYMETHYL)-2-(2-1,4,7,10,13)-PENTAOXA-16-AZACYCLOOCTADEC-16-YL-ACETOXYMETHYL)-3,4,6,7,8,9-HEXAHYDRO-2H-PYRIMIDO-[1,2-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H61F6N4O8PSi
InChI InChI=1S/C39H60N4O8Si.F6P/c1-39(2,3)52(35-10-6-4-7-11-35,36-12-8-5-9-13-36)51-32-34-15-17-43-16-14-33(40-38(43)41-34)31-50-37(44)30-42-18-20-45-22-24-47-26-28-49-29-27-48-25-23-46-21-19-42;1-7(2,3,4,5)6/h4-13,33-34H,14-32H2,1-3H3,(H,40,41);/q;-1/p+1/t33-,34-;/m0./s1
InChIKey ZYLKVEGBOQBIRR-GFLYYBHISA-O
Literature Reference Author P.BRECCIA,M.V.GOOL,R.PEREZ-FERNANDEZ,S.MARTIN-SANTAMARIA,F.G AGO,P.PRADOS,J.D.MEN
Literature Reference Citation J.AM.CHEM.SOC.,125,8270(2003)
Literature Reference DOI 10.1021/ja026860s
Molecular Weight 886.985 g/mol
Sample ID 41728
Solvent CDCl3