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CHEBI:109324 - 3-(2,4-difluoroanilino)-5,5-dimethyl-1-cyclohex-2-enone

Default Structure
ChEBI IDCHEBI:109324
ChEBI Name3-(2,4-difluoroanilino)-5,5-dimethyl-1-cyclohex-2-enone
Stars
DownloadsMolfile
FormulaC14H15F2NO
Net Charge0
Average Mass251.276
Monoisotopic Mass251.11217
SMILESCC1(C)CC(=O)C=C(Nc2ccc(F)cc2F)C1
InChIInChI=1S/C14H15F2NO/c1-14(2)7-10(6-11(18)8-14)17-13-4-3-9(15)5-12(13)16/h3-6,17H,7-8H2,1-2H3
InChIKeyXHITZSIFDPYHCU-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
3-(2,4-difluoroanilino)-5,5-dimethyl-1-cyclohex-2-enone (CHEBI:109324) is a substituted aniline (CHEBI:48975)
Manual XrefsDatabases
LSM-20722LINCS