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3-(3-Chloro-4-fluoro-phenylamino)-5,5-dimethyl-cyclohex-2-enone
SpectraBase Compound ID 4als3RE0rKS
InChI InChI=1S/C14H15ClFNO/c1-14(2)7-10(5-11(18)8-14)17-9-3-4-13(16)12(15)6-9/h3-6,17H,7-8H2,1-2H3
InChIKey QVRXIBRZRFFPKA-UHFFFAOYSA-N
Mol Weight 267.73 g/mol
Molecular Formula C14H15ClFNO
Exact Mass 267.08262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGZmklqRhQB
Name 3-(3-Chloro-4-fluoro-phenylamino)-5,5-dimethyl-cyclohex-2-enone
Alternate Name(s) 3-(3-Chloro-4-fluoro-anilino)-5,5-dimethyl-cyclohex-2-en-1-one 3-(3-Chloro-4-fluoroanilino)-5,5-dimethyl-1-cyclohex-2-enone 3-(3-Chloro-4-fluoroanilino)-5,5-dimethyl-2-cyclohexen-1-one 3-[(3-chloranyl-4-fluoranyl-phenyl)amino]-5,5-dimethyl-cyclohex-2-en-1-one
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Formula C14H15ClFNO
InChI InChI=1S/C14H15ClFNO/c1-14(2)7-10(5-11(18)8-14)17-9-3-4-13(16)12(15)6-9/h3-6,17H,7-8H2,1-2H3
InChIKey QVRXIBRZRFFPKA-UHFFFAOYSA-N
Molecular Weight 267.731 g/mol
SMILES N(C1=CC(=O)CC(C1)(C)C)c1cc(Cl)c(cc1)F
SPLASH splash10-02t9-9660000000-5eaefa3924d70afde50d
Wiley ID 1454739