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(3RS,5S,6R,7S,8S)-1,1-DICHLORO-4-OXASPIRO-[2.5]-OCTAN-5,6,7,8-TETRAYL-TETRABENZOATE

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(3RS,5S,6R,7S,8S)-1,1-DICHLORO-4-OXASPIRO-[2.5]-OCTAN-5,6,7,8-TETRAYL-TETRABENZOATE
SpectraBase Compound ID K3ox4EzgMFI
InChI InChI=1S/C35H26Cl2O9/c36-35(37)21-34(35)28(44-31(40)24-17-9-3-10-18-24)26(42-29(38)22-13-5-1-6-14-22)27(43-30(39)23-15-7-2-8-16-23)33(46-34)45-32(41)25-19-11-4-12-20-25/h1-20,26-28,33H,21H2/t26-,27-,28+,33-,34+/m0/s1
InChIKey PZKGNMZKNRSKDW-AEYKQXEWSA-N
Mol Weight 661.5 g/mol
Molecular Formula C35H26Cl2O9
Exact Mass 660.095388 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ILXboDcHn80
Name (3RS,5S,6R,7S,8S)-1,1-DICHLORO-4-OXASPIRO-[2.5]-OCTAN-5,6,7,8-TETRAYL-TETRABENZOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H26Cl2O9
InChI InChI=1S/C35H26Cl2O9/c36-35(37)21-34(35)28(44-31(40)24-17-9-3-10-18-24)26(42-29(38)22-13-5-1-6-14-22)27(43-30(39)23-15-7-2-8-16-23)33(46-34)45-32(41)25-19-11-4-12-20-25/h1-20,26-28,33H,21H2/t26-,27-,28+,33-,34+/m0/s1
InChIKey PZKGNMZKNRSKDW-AEYKQXEWSA-N
Literature Reference Author R.HUBER,L.P.MOLLEYRES,A.VASELLA
Literature Reference Citation HELV.CHIM.ACTA,73,1329(1990)
Literature Reference DOI 10.1002/hlca.19900730521
Molecular Weight 661.492 g/mol
Solvent CDCl3
Source File Reference UWED15669