For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(1-ALPHA,2-ALPHA,2A-BETA,2B-BETA,3-BETA,4-BETA,5A-BETA,6-ALPHA,6A-BETA)-3-BROMO-2B,3,4,5,5,5A-HEXACHLORO-DECAHYDRO-1-TRICHLOROMETHYL-2,4,6-METHENO-CYCLOBUTA-[A
SpectraBase Compound ID 3OgzSENaR3b
InChI InChI=1S/C12H6BrCl9/c13-11(20)7(14)3-1-4(10(17,18)19)2(3)6-5(1)8(7,15)12(21,22)9(6,11)16/h1-6H/t1-,2+,3+,4-,5-,6+,7+,8-,9+,11-/m0/s1
InChIKey YQOMZKCDGAPDMT-IZRLSEJXSA-N
Mol Weight 549.2 g/mol
Molecular Formula C12H6BrCl9
Exact Mass 543.684962 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KcwZUfMkyFS
Name (1-ALPHA,2-ALPHA,2A-BETA,2B-BETA,3-BETA,4-BETA,5A-BETA,6-ALPHA,6A-BETA)-3-BROMO-2B,3,4,5,5,5A-HEXACHLORO-DECAHYDRO-1-TRICHLOROMETHYL-2,4,6-METHENO-CYCLOBUTA-[A
CAS Registry Number 115419-79-9
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H6BrCl9
InChI InChI=1S/C12H6BrCl9/c13-11(20)7(14)3-1-4(10(17,18)19)2(3)6-5(1)8(7,15)12(21,22)9(6,11)16/h1-6H/t1-,2+,3+,4-,5-,6+,7+,8-,9+,11-/m0/s1
InChIKey YQOMZKCDGAPDMT-IZRLSEJXSA-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 549.161 g/mol
Solvent CDCl3
Source File Reference UWGB1656