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[(2R,3R,4S)-5-[(S)-HYDROXYMETHYL]-3-METHYL-4-AZONIA-1-BORANUIDASPIRO-[3.4]-OCTAN-2-YL]-TRIPHENYLPHOSPHONIUM-BROMIDE
SpectraBase Compound ID 4IYsM3EY0BX
InChI InChI=1S/C26H32BNOP.BrH/c1-21-26(27-28(21)19-11-12-22(28)20-29)30(23-13-5-2-6-14-23,24-15-7-3-8-16-24)25-17-9-4-10-18-25;/h2-10,13-18,21-22,26,29H,11-12,19-20,27H2,1H3;1H/q+1;/p-1/t21-,22?,26-,28?;/m1./s1
InChIKey ZFZYGMALPGLJLG-SYMMGUNQSA-M
Mol Weight 494.2 g/mol
Molecular Formula C26H30BBrNOP
Exact Mass 493.134145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 71ywVL27pjQ
Name [(2R,3R,4S)-5-[(S)-HYDROXYMETHYL]-3-METHYL-4-AZONIA-1-BORANUIDASPIRO-[3.4]-OCTAN-2-YL]-TRIPHENYLPHOSPHONIUM-BROMIDE
Compound Number 4DB
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30BBrNOP
InChI InChI=1S/C26H32BNOP.BrH/c1-21-26(27-28(21)19-11-12-22(28)20-29)30(23-13-5-2-6-14-23,24-15-7-3-8-16-24)25-17-9-4-10-18-25;/h2-10,13-18,21-22,26,29H,11-12,19-20,27H2,1H3;1H/q+1;/p-1/t21-,22?,26-,28?;/m1./s1
InChIKey ZFZYGMALPGLJLG-SYMMGUNQSA-M
Literature Reference Author B.L.BOOTH,N.J.LAWRENCE,H.S.RASHID
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3509(1997)
Literature Reference DOI 10.1039/a703936k
Molecular Weight 494.218 g/mol
Solvent CDCl3
Source File Reference UWRU8076