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ACETIC-ACID-[(1A-ALPHA,2-BETA,2A-BETA,3-ALPHA,6-ALPHA,6A-BETA,6B-ALPHA)-3,4,5,6,7,7-HEXACHLORO-1,1A,2,2A,3,6,6A,6B-OCTAHYDRO-3,6-METHANOCYCLOPROPA-[A]-INDEN-2-
SpectraBase Compound ID G0YfKdl4tvi
InChI InChI=1S/C13H10Cl6O2/c1-3(20)21-8-5-2-4(5)6-7(8)12(17)10(15)9(14)11(6,16)13(12,18)19/h4-8H,2H2,1H3/t4-,5+,6+,7+,8+,11-,12+/m1/s1
InChIKey LIJZNVDGUDREGO-HUCFZASWSA-N
Mol Weight 410.9 g/mol
Molecular Formula C13H10Cl6O2
Exact Mass 407.881196 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 15lsf8KdsDx
Name ACETIC-ACID-[(1A-ALPHA,2-BETA,2A-BETA,3-ALPHA,6-ALPHA,6A-BETA,6B-ALPHA)-3,4,5,6,7,7-HEXACHLORO-1,1A,2,2A,3,6,6A,6B-OCTAHYDRO-3,6-METHANOCYCLOPROPA-[A]-INDEN-2-
CAS Registry Number 115408-28-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10Cl6O2
InChI InChI=1S/C13H10Cl6O2/c1-3(20)21-8-5-2-4(5)6-7(8)12(17)10(15)9(14)11(6,16)13(12,18)19/h4-8H,2H2,1H3/t4-,5+,6+,7+,8+,11-,12+/m1/s1
InChIKey LIJZNVDGUDREGO-HUCFZASWSA-N
Literature Reference Author S.FREUND,H.HENNEBERGER,M.CHRISTL
Literature Reference Citation CHEM.BER.,121,1665(1988)
Literature Reference DOI 10.1002/cber.19881210920
Molecular Weight 410.939 g/mol
Solvent CDCl3
Source File Reference UWGB1659