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[(1S,3R,4S,1'S)-4-METHYL-1-(1-PHENYLETHYL)-1,2-AZABORETIDIN-1-IUM-2-UID-3-YL]-TRIPHENYLPHOSPHONIUM-BROMIDE
SpectraBase Compound ID 7gXKHbiApff
InChI InChI=1S/C29H32BNP.BrH/c1-23(25-15-7-3-8-16-25)31-24(2)29(30-31)32(26-17-9-4-10-18-26,27-19-11-5-12-20-27)28-21-13-6-14-22-28;/h3-24,29,31H,30H2,1-2H3;1H/q+1;/p-1/t23-,24-,29-;/m0./s1
InChIKey CCOYYZDORMWEIM-SAEHFMPMSA-M
Mol Weight 514.254 g/mol
Molecular Formula C29H30BBrNP
Exact Mass 513.13923 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5gKyC5Yq7vA
Name [(1S,3R,4S,1'S)-4-METHYL-1-(1-PHENYLETHYL)-1,2-AZABORETIDIN-1-IUM-2-UID-3-YL]-TRIPHENYLPHOSPHONIUM-BROMIDE
Compound Number 4CA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H30BBrNP
InChI InChI=1S/C29H32BNP.BrH/c1-23(25-15-7-3-8-16-25)31-24(2)29(30-31)32(26-17-9-4-10-18-26,27-19-11-5-12-20-27)28-21-13-6-14-22-28;/h3-24,29,31H,30H2,1-2H3;1H/q+1;/p-1/t23-,24-,29-;/m0./s1
InChIKey CCOYYZDORMWEIM-SAEHFMPMSA-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 514.252 g/mol
Solvent CDCl3