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(2S,8S)-8-(2-BROMOACETOXYMETHYL)-2-(TERT.-BUTYLDIPHENYLSILANYLOXYMETHYL)-3,4,6,7,8,9-HEXAHYDRO-2H-PYRIMIDO-[1,2-A]-PYRIMIDIN-1-IUM

View entire compound with spectra: 1 NMR

(2S,8S)-8-(2-BROMOACETOXYMETHYL)-2-(TERT.-BUTYLDIPHENYLSILANYLOXYMETHYL)-3,4,6,7,8,9-HEXAHYDRO-2H-PYRIMIDO-[1,2-A]-PYRIMIDIN-1-IUM
SpectraBase Compound ID 1xoyPKxXxEU
InChI InChI=1S/C27H36BrN3O3Si.F6P/c1-27(2,3)35(23-10-6-4-7-11-23,24-12-8-5-9-13-24)34-20-22-15-17-31-16-14-21(29-26(31)30-22)19-33-25(32)18-28;1-7(2,3,4,5)6/h4-13,21-22H,14-20H2,1-3H3,(H,29,30);/q;-1/p+1/t21-,22-;/m0./s1
InChIKey WPXAIIMBNSDXKN-VROPFNGYSA-O
Mol Weight 704.6 g/mol
Molecular Formula C27H37BrF6N3O3PSi
Exact Mass 703.142938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fa5cyRxFj3x
Name (2S,8S)-8-(2-BROMOACETOXYMETHYL)-2-(TERT.-BUTYLDIPHENYLSILANYLOXYMETHYL)-3,4,6,7,8,9-HEXAHYDRO-2H-PYRIMIDO-[1,2-A]-PYRIMIDIN-1-IUM
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H37BrF6N3O3PSi
InChI InChI=1S/C27H36BrN3O3Si.F6P/c1-27(2,3)35(23-10-6-4-7-11-23,24-12-8-5-9-13-24)34-20-22-15-17-31-16-14-21(29-26(31)30-22)19-33-25(32)18-28;1-7(2,3,4,5)6/h4-13,21-22H,14-20H2,1-3H3,(H,29,30);/q;-1/p+1/t21-,22-;/m0./s1
InChIKey WPXAIIMBNSDXKN-VROPFNGYSA-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 704.563 g/mol
Sample ID 41727
Solvent CDCl3