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(3Z)-3-Chloromethyl-4-(4-trifloromethylphenyl)but-3-en-2-one
SpectraBase Compound ID LkrVJHWY8K0
InChI InChI=1S/C12H10ClF3O/c1-8(17)10(7-13)6-9-2-4-11(5-3-9)12(14,15)16/h2-6H,7H2,1H3/b10-6+
InChIKey LPGJOPHGVDQDPV-UXBLZVDNSA-N
Mol Weight 262.66 g/mol
Molecular Formula C12H10ClF3O
Exact Mass 262.037227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EzBA1qtOWgu
Name (3Z)-3-Chloromethyl-4-(4-trifloromethylphenyl)but-3-en-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H10ClF3O
InChI InChI=1S/C12H10ClF3O/c1-8(17)10(7-13)6-9-2-4-11(5-3-9)12(14,15)16/h2-6H,7H2,1H3/b10-6+
InChIKey LPGJOPHGVDQDPV-UXBLZVDNSA-N
Molecular Weight 262.659 g/mol
SMILES C(c1ccc(\C=C\(C(=O)C)CCl)cc1)(F)(F)F
SPLASH splash10-03xr-0690000000-0181a0396ea374e7070b
Source of Spectrum KC-57-8460-7
Synonyms 3-(Chloromethyl)-4-(4'-trifluoromethylphenyl)-3-buten-2-one (3Z)-3-(chloromethyl)-4-[4-(trifluoromethyl)phenyl]-3-buten-2-one (Z)-3-(chloromethyl)-4-[4-(trifluoromethyl)phenyl]-3-buten-2-one
Wiley ID 1626054