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(3S,4S)-1-methyl-4-(4-prop-2-enylphenyl)-3-piperidinecarboxylic acid methyl ester
SpectraBase Compound ID FQaCzRLhYbC
InChI InChI=1S/C17H23NO2/c1-4-5-13-6-8-14(9-7-13)15-10-11-18(2)12-16(15)17(19)20-3/h4,6-9,15-16H,1,5,10-12H2,2-3H3/t15-,16-/m1/s1
InChIKey DGCNABOMMDHQQW-HZPDHXFCSA-N
Mol Weight 273.38 g/mol
Molecular Formula C17H23NO2
Exact Mass 273.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1G9dbC8R1GU
Name (3S,4S)-1-methyl-4-(4-prop-2-enylphenyl)-3-piperidinecarboxylic acid methyl ester
Alternate Name(s) (3S,4S)-4-(4-allylphenyl)-1-methyl-nipecotic acid methyl ester Methyl (3S,4S)-1-methyl-4-(4-prop-2-enylphenyl)piperidine-3-carboxylate Methyl (3S,4S)-4-(4-allylphenyl)-1-methyl-piperidine-3-carboxylate
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Formula C17H23NO2
InChI InChI=1S/C17H23NO2/c1-4-5-13-6-8-14(9-7-13)15-10-11-18(2)12-16(15)17(19)20-3/h4,6-9,15-16H,1,5,10-12H2,2-3H3/t15-,16-/m1/s1
InChIKey DGCNABOMMDHQQW-HZPDHXFCSA-N
Molecular Weight 273.376 g/mol
SMILES C1N(CC[C@@]([C@@]1(C(=O)OC)[H])(c1ccc(cc1)CC=C)[H])C
SPLASH splash10-0006-9010000000-3da55a5cf48133d6fe9e
Source of Spectrum F2-43-1221-16
Wiley ID 1600581