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(1s,4r,5R,6R,7S,8S)-5,6,7,8-tetrakis(chloromethyl)bicyclo[2.2.2]octan-2-one

View entire compound with spectra: 1 MS (GC)

(1s,4r,5R,6R,7S,8S)-5,6,7,8-tetrakis(chloromethyl)bicyclo[2.2.2]octan-2-one
SpectraBase Compound ID 9kYiXMZJm0T
InChI InChI=1S/C12H16Cl4O/c13-2-7-6-1-11(17)12(9(7)4-15)10(5-16)8(6)3-14/h6-10,12H,1-5H2/t6-,7-,8+,9-,10-,12+/m1/s1
InChIKey JEBFPSWWLIXYCM-LRZXIGISSA-N
Mol Weight 318.1 g/mol
Molecular Formula C12H16Cl4O
Exact Mass 315.995526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jj4Q0XXoD0O
Name (1s,4r,5R,6R,7S,8S)-5,6,7,8-tetrakis(chloromethyl)bicyclo[2.2.2]octan-2-one
CAS Registry Number 113565-18-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16Cl4O
InChI InChI=1S/C12H16Cl4O/c13-2-7-6-1-11(17)12(9(7)4-15)10(5-16)8(6)3-14/h6-10,12H,1-5H2/t6-,7-,8+,9-,10-,12+/m1/s1
InChIKey JEBFPSWWLIXYCM-LRZXIGISSA-N
Molecular Weight 318.071 g/mol
SMILES [C@]12([C@]([C@@](CCl)([C@@](C(C2)=O)([H])[C@@]([C@]1(CCl)[H])(CCl)[H])[H])(CCl)[H])[H]
SPLASH splash10-0v03-4951000000-2670aa1d2a37c0db8354
Source of Spectrum H-71-1260-32
Synonyms (5R,6R,7S,8S)-5,6,7,8-tetrakis(chloromethyl)bicyclo[2.2.2]octan-2-one
Wiley ID 1316328