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TERT.-BUTYL-3-[HYDROXY-(PHENYL)-METHYL]-5-OXO-5-PHENYL-2-(1,1,1-TRIPHENYL-LAMBDA-(5)-PHOSPHANYLIDENE)-ACETATE
SpectraBase Compound ID IYtN9dikrcN
InChI InChI=1S/C40H39O4P/c1-40(2,3)44-39(43)38(35(37(42)31-21-11-5-12-22-31)29-36(41)30-19-9-4-10-20-30)45(32-23-13-6-14-24-32,33-25-15-7-16-26-33)34-27-17-8-18-28-34/h4-28,35,37,42H,29H2,1-3H3/t35-,37+/m0/s1
InChIKey LALLAPKEAFPJIW-YBZKQSBQSA-N
Mol Weight 614.7 g/mol
Molecular Formula C40H39O4P
Exact Mass 614.258597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H5koiNGTuUb
Name TERT.-BUTYL-3-[HYDROXY-(PHENYL)-METHYL]-5-OXO-5-PHENYL-2-(1,1,1-TRIPHENYL-LAMBDA-(5)-PHOSPHANYLIDENE)-ACETATE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H39O4P
InChI InChI=1S/C40H39O4P/c1-40(2,3)44-39(43)38(35(37(42)31-21-11-5-12-22-31)29-36(41)30-19-9-4-10-20-30)45(32-23-13-6-14-24-32,33-25-15-7-16-26-33)34-27-17-8-18-28-34/h4-28,35,37,42H,29H2,1-3H3/t35-,37+/m0/s1
InChIKey LALLAPKEAFPJIW-YBZKQSBQSA-N
Literature Reference Author T.D.AVERY,G.FALLON,B.W.GREATREX,S.M.PYKE,D.K.TAYLOR,E.R.T.TI EKINK
Literature Reference Citation J.ORG.CHEM.,66,7955(2001)
Literature Reference DOI 10.1021/jo001599o
Molecular Weight 614.721 g/mol
Solvent CDCl3
Source File Reference UWVN25919