MESO-4,4'-METHYLENEBIS-[(1R,1'S,2S,2'R,6R,6'S)-6-ACETOXY-2-CHLOROCYCLOHEPT-3-EN-1-YL]-BIS-(4-METHOXYBENZOATE)

SpectraBase Compound ID	5Bo8WvpKx6n
InChI	InChI=1S/C35H38Cl2O10/c1-20(38)44-28-14-22(16-30(36)32(18-28)46-34(40)24-5-9-26(42-3)10-6-24)13-23-15-29(45-21(2)39)19-33(31(37)17-23)47-35(41)25-7-11-27(43-4)12-8-25/h5-12,16-17,28-33H,13-15,18-19H2,1-4H3/t28-,29+,30+,31-,32-,33+
InChIKey	DSCPZIKRFJYQQQ-MSYZAOLGSA-N Google Search
Mol Weight	689.6 g/mol
Molecular Formula	C35H38Cl2O10
Exact Mass	688.184203 g/mol

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SpectraBase Spectrum ID	C4uQ1Mi8bx9
Name	MESO-4,4'-METHYLENEBIS-[(1R,1'S,2S,2'R,6R,6'S)-6-ACETOXY-2-CHLOROCYCLOHEPT-3-EN-1-YL]-BIS-(4-METHOXYBENZOATE)
Compound Number	19
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C35H38Cl2O10
InChI	InChI=1S/C35H38Cl2O10/c1-20(38)44-28-14-22(16-30(36)32(18-28)46-34(40)24-5-9-26(42-3)10-6-24)13-23-15-29(45-21(2)39)19-33(31(37)17-23)47-35(41)25-7-11-27(43-4)12-8-25/h5-12,16-17,28-33H,13-15,18-19H2,1-4H3/t28-,29+,30+,31-,32-,33+
InChIKey	DSCPZIKRFJYQQQ-MSYZAOLGSA-N
Literature Reference Author	S.GERBER-LEMAIRE,A.T.CARMONA,K.T.MEILERT,P.VOGEL
Literature Reference Citation	EUR.J.ORG.CHEM.,891(2006)
Molecular Weight	689.587 g/mol
Sample ID	43621
Solvent	CDCl3