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1-[(1S)-1-phenylethyl]-4-(phenylmethoxycarbonylamino)-4-piperidinecarboxylic acid methyl ester
SpectraBase Compound ID 91bq5rwR8ke
InChI InChI=1S/C23H28N2O4/c1-18(20-11-7-4-8-12-20)25-15-13-23(14-16-25,21(26)28-2)24-22(27)29-17-19-9-5-3-6-10-19/h3-12,18H,13-17H2,1-2H3,(H,24,27)/t18-/m0/s1
InChIKey KKOOGMCSNKUGOX-SFHVURJKSA-N
Mol Weight 396.49 g/mol
Molecular Formula C23H28N2O4
Exact Mass 396.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrNrQvl0yHw
Name 1-[(1S)-1-phenylethyl]-4-(phenylmethoxycarbonylamino)-4-piperidinecarboxylic acid methyl ester
Alternate Name(s) 4-(benzyloxycarbonylamino)-1-[(1S)-1-phenylethyl]isonipecotic acid methyl ester Methyl 1-[(1S)-1-phenylethyl]-4-(phenylmethoxycarbonylamino)piperidine-4-carboxylate Methyl 4-(benzyloxycarbonylamino)-1-[(1S)-1-phenylethyl]piperidine-4-carboxylate
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Formula C23H28N2O4
InChI InChI=1S/C23H28N2O4/c1-18(20-11-7-4-8-12-20)25-15-13-23(14-16-25,21(26)28-2)24-22(27)29-17-19-9-5-3-6-10-19/h3-12,18H,13-17H2,1-2H3,(H,24,27)/t18-/m0/s1
InChIKey KKOOGMCSNKUGOX-SFHVURJKSA-N
Molecular Weight 396.487 g/mol
SMILES N(C(=O)OCc1ccccc1)C1(C(=O)OC)CCN(CC1)[C@](c1ccccc1)(C)[H]
SPLASH splash10-0006-6935000000-ad41ed517372b166f058
Source of Spectrum KC-61-596-4
Wiley ID 1627153