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METHYL-(1R,3R,3AR,6R,8S)-3-DICHLOROACETOXY-5,5-ETHYLENEDIOXY-8-HYDROXY-1,2,3,4,5,6-HEXAHYDRO-3A,6-ETHANO-3AH-INDENE-1-CARBOXYLATE

View entire compound with spectra: 1 NMR

METHYL-(1R,3R,3AR,6R,8S)-3-DICHLOROACETOXY-5,5-ETHYLENEDIOXY-8-HYDROXY-1,2,3,4,5,6-HEXAHYDRO-3A,6-ETHANO-3AH-INDENE-1-CARBOXYLATE
SpectraBase Compound ID 9wsyrrDnMQ8
InChI InChI=1S/C17H20Cl2O7/c1-23-14(21)8-4-12(26-15(22)13(18)19)16-6-11(20)10(5-9(8)16)17(7-16)24-2-3-25-17/h5,8,10-13,20H,2-4,6-7H2,1H3/t8-,10-,11+,12-,16-/m1/s1
InChIKey LQMGEXRHNSUKIL-FFDXVPRCSA-N
Mol Weight 407.25 g/mol
Molecular Formula C17H20Cl2O7
Exact Mass 406.058608 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KCxip9MyJog
Name METHYL-(1R,3R,3AR,6R,8S)-3-DICHLOROACETOXY-5,5-ETHYLENEDIOXY-8-HYDROXY-1,2,3,4,5,6-HEXAHYDRO-3A,6-ETHANO-3AH-INDENE-1-CARBOXYLATE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20Cl2O7
InChI InChI=1S/C17H20Cl2O7/c1-23-14(21)8-4-12(26-15(22)13(18)19)16-6-11(20)10(5-9(8)16)17(7-16)24-2-3-25-17/h5,8,10-13,20H,2-4,6-7H2,1H3/t8-,10-,11+,12-,16-/m1/s1
InChIKey LQMGEXRHNSUKIL-FFDXVPRCSA-N
Literature Reference Author C.K.F.CHIU,L.N.MANDER,A.D.STUART,A.C.WILLIS
Literature Reference Citation AUSTR.J.CHEM.,45,227(1992)
Literature Reference DOI 10.1071/ch9920227
Molecular Weight 407.248 g/mol
Solvent CDCl3
Source File Reference UWRK1794