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(1'RS,2SR,2'E,2''EZ,3SR)-3-[3'-(DIPHENYLPHOSPHINYL)-1'-METHYL-PROP-2'-ENYL]-2-METHYL-2-[4''-(PHENYLSULFONYL)-BUT-2''-ENYL]-CYClOPENTANONE

View entire compound with spectra: 1 NMR

(1'RS,2SR,2'E,2''EZ,3SR)-3-[3'-(DIPHENYLPHOSPHINYL)-1'-METHYL-PROP-2'-ENYL]-2-METHYL-2-[4''-(PHENYLSULFONYL)-BUT-2''-ENYL]-CYClOPENTANONE
SpectraBase Compound ID FDUukmlhK8C
InChI InChI=1S/C32H35O4PS/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/h3-19,22,24,26,30H,20-21,23,25H2,1-2H3/b13-12+,24-22+/t26-,30-,32-/m0/s1
InChIKey KPLVUDQPIXSUML-BBLMGWRMSA-N
Mol Weight 546.7 g/mol
Molecular Formula C32H35O4PS
Exact Mass 546.199368 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LBiSMQ44pff
Name (1'RS,2SR,2'E,2''EZ,3SR)-3-[3'-(DIPHENYLPHOSPHINYL)-1'-METHYL-PROP-2'-ENYL]-2-METHYL-2-[4''-(PHENYLSULFONYL)-BUT-2''-ENYL]-CYClOPENTANONE
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H35O4PS
InChI InChI=1S/C32H35O4PS/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/h3-19,22,24,26,30H,20-21,23,25H2,1-2H3/b13-12+,24-22+/t26-,30-,32-/m0/s1
InChIKey KPLVUDQPIXSUML-BBLMGWRMSA-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 546.661 g/mol
Solvent CDCl3
Source File Reference UWRK3104