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1-[2-(4-Fluoroanilino)-2-keto-ethyl]-4-phenyl-isonipecotic acid ethyl ester
SpectraBase Compound ID AMRTl2ZLTkD
InChI InChI=1S/C22H25FN2O3/c1-2-28-21(27)22(17-6-4-3-5-7-17)12-14-25(15-13-22)16-20(26)24-19-10-8-18(23)9-11-19/h3-11H,2,12-16H2,1H3,(H,24,26)
InChIKey VNWUWTPCMSKOPH-UHFFFAOYSA-N
Mol Weight 384.45 g/mol
Molecular Formula C22H25FN2O3
Exact Mass 384.184921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUJ0hmvgj8k
Name 1-[2-(4-fluoroanilino)-2-keto-ethyl]-4-phenyl-isonipecotic acid ethyl ester
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Formula C22H25FN2O3
InChI InChI=1S/C22H25FN2O3/c1-2-28-21(27)22(17-6-4-3-5-7-17)12-14-25(15-13-22)16-20(26)24-19-10-8-18(23)9-11-19/h3-11H,2,12-16H2,1H3,(H,24,26)
InChIKey VNWUWTPCMSKOPH-UHFFFAOYSA-N
Molecular Weight 384.451 g/mol
SMILES N(C(CN1CCC(C(=O)OCC)(CC1)c1ccccc1)=O)c1ccc(F)cc1
SPLASH splash10-0002-2590000000-9b421ff4b3aa7254c709
Synonyms 1-[2-(4-fluoroanilino)-2-oxoethyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester Ethyl 1-[2-(4-fluoroanilino)-2-oxo-ethyl]-4-phenyl-piperidine-4-carboxylate Ethyl 1-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-4-carboxylate
Wiley ID 1452878