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N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide
SpectraBase Compound ID 2x2q64XkQL
InChI InChI=1S/C20H16ClF6N3O3/c21-14-3-1-12(19(22,23)24)9-15(14)28-18(31)11-5-7-29(8-6-11)16-4-2-13(20(25,26)27)10-17(16)30(32)33/h1-4,9-11H,5-8H2,(H,28,31)
InChIKey GKHAGGSGQZUMBB-UHFFFAOYSA-N
Mol Weight 495.81 g/mol
Molecular Formula C20H16ClF6N3O3
Exact Mass 495.078438 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 31bzieIFIu
Name N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide
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Formula C20H16ClF6N3O3
InChI InChI=1S/C20H16ClF6N3O3/c21-14-3-1-12(19(22,23)24)9-15(14)28-18(31)11-5-7-29(8-6-11)16-4-2-13(20(25,26)27)10-17(16)30(32)33/h1-4,9-11H,5-8H2,(H,28,31)
InChIKey GKHAGGSGQZUMBB-UHFFFAOYSA-N
Molecular Weight 495.809 g/mol
SMILES N(C(C1CCN(c2c(N(=O)=O)cc(C(F)(F)F)cc2)CC1)=O)c1cc(C(F)(F)F)ccc1Cl
SPLASH splash10-0kg9-1590100000-066a921de70a7a9b8532
Synonyms N-[2-chloro-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide N-[2-chloro-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide N-[2-chloro-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide
Wiley ID 1437078