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2-Chloro-3-(trichloromethyl)-cyclohexan-1-one
SpectraBase Compound ID D8AS7BooBTi
InChI InChI=1S/C7H8Cl4O/c8-6-4(7(9,10)11)2-1-3-5(6)12/h4,6H,1-3H2
InChIKey QAGUYVGMALTFFX-UHFFFAOYSA-N
Mol Weight 250.0 g/mol
Molecular Formula C7H8Cl4O
Exact Mass 247.932926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6vRRPYn0Zz9
Name 2-Chloro-3-(trichloromethyl)-cyclohexan-1-one
Alternate Name(s) 2-chloro-3-(trichloromethyl)cyclohexanone
Comments Less than 3 mono-isotopic peaks
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Formula C7H8Cl4O
InChI InChI=1S/C7H8Cl4O/c8-6-4(7(9,10)11)2-1-3-5(6)12/h4,6H,1-3H2
InChIKey QAGUYVGMALTFFX-UHFFFAOYSA-N
Molecular Weight 249.952 g/mol
SMILES C1(C(C(CCC1)C(Cl)(Cl)Cl)Cl)=O
SPLASH splash10-0udi-0090000000-6c0119c72bcc6157af60
Source of Spectrum G-72-1010-22
Wiley ID 1587677