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(1'RS,2SR,2'E,3SR)-3-[3'-(DIPHENYLPHOSPHINOYL)-1'-METHYLPROP-2'-ENYL]-2-METHYL-2-[4''-(PHENYLSULFONYL)-BUT-2''-YNYL]-CYClOPENTANONE
SpectraBase Compound ID 7GUrSGNTGDY
InChI InChI=1S/C32H33O4PS/c1-26(22-24-37(34,27-14-6-3-7-15-27)28-16-8-4-9-17-28)30-20-21-31(33)32(30,2)23-12-13-25-38(35,36)29-18-10-5-11-19-29/h3-11,14-19,22,24,26,30H,20-21,23,25H2,1-2H3/b24-22+/t26-,30-,32-/m0/s1
InChIKey XRGQDZNCKGSGFB-GUCLRBLVSA-N
Mol Weight 544.6 g/mol
Molecular Formula C32H33O4PS
Exact Mass 544.183718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D8VfnHdXQtb
Name (1'RS,2SR,2'E,3SR)-3-[3'-(DIPHENYLPHOSPHINOYL)-1'-METHYLPROP-2'-ENYL]-2-METHYL-2-[4''-(PHENYLSULFONYL)-BUT-2''-YNYL]-CYClOPENTANONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H33O4PS
InChI InChI=1S/C32H33O4PS/c1-26(22-24-37(34,27-14-6-3-7-15-27)28-16-8-4-9-17-28)30-20-21-31(33)32(30,2)23-12-13-25-38(35,36)29-18-10-5-11-19-29/h3-11,14-19,22,24,26,30H,20-21,23,25H2,1-2H3/b24-22+/t26-,30-,32-/m0/s1
InChIKey XRGQDZNCKGSGFB-GUCLRBLVSA-N
Literature Reference Author W.A.LOUGHLIN,R.K.HAYNES,S.SITPASEUTH
Literature Reference Citation AUSTR.J.CHEM.,48,491(1995)
Literature Reference DOI 10.1071/CH9950491
Molecular Weight 544.645 g/mol
Solvent CDCl3
Source File Reference UWRK3101