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2,2,2-trifluoroethyl 2-[[1-(2-chlorophenyl)-3-ethoxy-3-oxo-propyl]carbamoyl]cyclohexanecarboxylate
SpectraBase Compound ID Dhw1YjvVe3E
InChI InChI=1S/C21H25ClF3NO5/c1-2-30-18(27)11-17(15-9-5-6-10-16(15)22)26-19(28)13-7-3-4-8-14(13)20(29)31-12-21(23,24)25/h5-6,9-10,13-14,17H,2-4,7-8,11-12H2,1H3,(H,26,28)
InChIKey YETSFNAMGSRZAE-UHFFFAOYSA-N
Mol Weight 463.88 g/mol
Molecular Formula C21H25ClF3NO5
Exact Mass 463.137335 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29lQpeTDNPv
Name 2,2,2-trifluoroethyl 2-[[1-(2-chlorophenyl)-3-ethoxy-3-oxo-propyl]carbamoyl]cyclohexanecarboxylate
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Formula C21H25ClF3NO5
InChI InChI=1S/C21H25ClF3NO5/c1-2-30-18(27)11-17(15-9-5-6-10-16(15)22)26-19(28)13-7-3-4-8-14(13)20(29)31-12-21(23,24)25/h5-6,9-10,13-14,17H,2-4,7-8,11-12H2,1H3,(H,26,28)
InChIKey YETSFNAMGSRZAE-UHFFFAOYSA-N
Molecular Weight 463.881 g/mol
SMILES N(C(=O)C1C(CCCC1)C(OCC(F)(F)F)=O)C(CC(OCC)=O)c1c(cccc1)Cl
SPLASH splash10-003u-8910000000-7e58709726f228da1db6
Synonyms 2,2,2-trifluoroethyl 2-[[1-(2-chlorophenyl)-3-ethoxy-3-oxopropyl]carbamoyl]cyclohexane-1-carboxylate 2,2,2-tris(fluoranyl)ethyl 2-[[1-(2-chlorophenyl)-3-ethoxy-3-oxidanylidene-propyl]carbamoyl]cyclohexane-1-carboxylate 2-[[1-(2-chlorophenyl)-3-ethoxy-3-keto-propyl]carbamoyl]cyclohexanecarboxylic acid 2,2,2-trifluoroethyl ester 2-[[[1-(2-chlorophenyl)-3-ethoxy-3-oxopropyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid 2,2,2-trifluoroethyl ester
Wiley ID 1445817