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#16;(2S,8S)-2-(TERT.-BUTYLDIPHENYLSILANYLOXYMETHYL)-8-[[(NAPHTHALENE-2-CARBONYL)-AMINO]-METHYL]-3,4,6,7,8,9-HEXAHYDRO-2H-PYRIMIDO-[1,2-A]-PYRIMIDIN-1-IUM
SpectraBase Compound ID LJoTn782soj
InChI InChI=1S/C36H42N4O2Si.F6P/c1-36(2,3)43(32-14-6-4-7-15-32,33-16-8-5-9-17-33)42-26-31-21-23-40-22-20-30(38-35(40)39-31)25-37-34(41)29-19-18-27-12-10-11-13-28(27)24-29;1-7(2,3,4,5)6/h4-19,24,30-31H,20-23,25-26H2,1-3H3,(H,37,41)(H,38,39);/q;-1/p+1/t30-,31-;/m0./s1
InChIKey BZXQVIXJZNYJCA-PNXDLZEOSA-O
Mol Weight 736.8 g/mol
Molecular Formula C36H43F6N4O2PSi
Exact Mass 736.279709 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K99BgCxehsa
Name #16;(2S,8S)-2-(TERT.-BUTYLDIPHENYLSILANYLOXYMETHYL)-8-[[(NAPHTHALENE-2-CARBONYL)-AMINO]-METHYL]-3,4,6,7,8,9-HEXAHYDRO-2H-PYRIMIDO-[1,2-A]-PYRIMIDIN-1-IUM
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H43F6N4O2PSi
InChI InChI=1S/C36H42N4O2Si.F6P/c1-36(2,3)43(32-14-6-4-7-15-32,33-16-8-5-9-17-33)42-26-31-21-23-40-22-20-30(38-35(40)39-31)25-37-34(41)29-19-18-27-12-10-11-13-28(27)24-29;1-7(2,3,4,5)6/h4-19,24,30-31H,20-23,25-26H2,1-3H3,(H,37,41)(H,38,39);/q;-1/p+1/t30-,31-;/m0./s1
InChIKey BZXQVIXJZNYJCA-PNXDLZEOSA-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 736.813 g/mol
Sample ID 41733
Solvent CDCl3