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(1-ALPHA,2-ALPHA,2A-BETA,2B-BETA,3-ALPHA,4-BETA,5A-BETA,6-ALPHA,6A-BETA)-2B,3,4,5A-TETRACHLORO-OCTAHYDRO-1-PHENYLTHIO-2,4,6-METHENO-1H-CYCLOBUTA-[4.5]-CYCLOPEN
SpectraBase Compound ID C30x5XEiSOh
InChI InChI=1S/C16H12Cl4OS/c17-13-14(18)9-7-10-11(16(14,20)21-15(10,13)19)8(9)12(7)22-6-4-2-1-3-5-6/h1-5,7-13H/t7-,8+,9-,10+,11-,12-,13+,14-,15-,16+/m0/s1
InChIKey VSFPRGFXWKXRNT-PJADNEFKSA-N
Mol Weight 394.1 g/mol
Molecular Formula C16H12Cl4OS
Exact Mass 391.936297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PPkA51TNQa
Name (1-ALPHA,2-ALPHA,2A-BETA,2B-BETA,3-ALPHA,4-BETA,5A-BETA,6-ALPHA,6A-BETA)-2B,3,4,5A-TETRACHLORO-OCTAHYDRO-1-PHENYLTHIO-2,4,6-METHENO-1H-CYCLOBUTA-[4.5]-CYCLOPEN
CAS Registry Number 115408-20-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12Cl4OS
InChI InChI=1S/C16H12Cl4OS/c17-13-14(18)9-7-10-11(16(14,20)21-15(10,13)19)8(9)12(7)22-6-4-2-1-3-5-6/h1-5,7-13H/t7-,8+,9-,10+,11-,12-,13+,14-,15-,16+/m0/s1
InChIKey VSFPRGFXWKXRNT-PJADNEFKSA-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 394.143 g/mol
Solvent CDCl3
Source File Reference UWGB1652