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(1S,2S,4R,5R,E)-2-bromo-1-(bromomethyl)-1,4-dichloro-5-(2-chlorovinyl)-5-methylcyclohexane
SpectraBase Compound ID EeXV4UCch5S
InChI InChI=1S/C10H13Br2Cl3/c1-9(2-3-13)5-10(15,6-11)7(12)4-8(9)14/h2-3,7-8H,4-6H2,1H3/b3-2+/t7-,8+,9-,10-/m0/s1
InChIKey MMMYYEWTEBVZHZ-MZXHXKKRSA-N
Mol Weight 399.38 g/mol
Molecular Formula C10H13Br2Cl3
Exact Mass 395.84496 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3Ob6yujGuC
Name (1S,2S,4R,5R,E)-2-bromo-1-(bromomethyl)-1,4-dichloro-5-(2-chlorovinyl)-5-methylcyclohexane
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Formula C10H13Br2Cl3
InChI InChI=1S/C10H13Br2Cl3/c1-9(2-3-13)5-10(15,6-11)7(12)4-8(9)14/h2-3,7-8H,4-6H2,1H3/b3-2+/t7-,8+,9-,10-/m0/s1
InChIKey MMMYYEWTEBVZHZ-MZXHXKKRSA-N
Literature Reference DOI 10.1002/pca.1075
Molecular Weight 399.381 g/mol
SMILES [C@]1(\C=C\Cl)(C)[C@@](C[C@@]([C@@](Cl)(CBr)C1)(Br)[H])(Cl)[H]
SPLASH splash10-0f6t-0391000000-2ddbce0ffda70244c8eb
Source of Spectrum PA-19-468-7
Synonyms (1S,2S,4R,5R)-2-bromo-1-(bromomethyl)-1,4-dichloro-5-((E)-2-chlorovinyl)-5-methylcyclohexane
Wiley ID 1789615