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Isobutyl (3S,4R)-1-Benzyl-4-(4-fluorophenyl)piperidine-3-carboxylate
SpectraBase Compound ID DhJN8IPjxC7
InChI InChI=1S/C23H28FNO2/c1-17(2)16-27-23(26)22-15-25(14-18-6-4-3-5-7-18)13-12-21(22)19-8-10-20(24)11-9-19/h3-11,17,21-22H,12-16H2,1-2H3/t21-,22+/m0/s1
InChIKey CGEISGJJZDGKSH-FCHUYYIVSA-N
Mol Weight 369.48 g/mol
Molecular Formula C23H28FNO2
Exact Mass 369.210407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K43NtxNz7Af
Name Isobutyl (3S,4R)-1-Benzyl-4-(4-fluorophenyl)piperidine-3-carboxylate
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Formula C23H28FNO2
InChI InChI=1S/C23H28FNO2/c1-17(2)16-27-23(26)22-15-25(14-18-6-4-3-5-7-18)13-12-21(22)19-8-10-20(24)11-9-19/h3-11,17,21-22H,12-16H2,1-2H3/t21-,22+/m0/s1
InChIKey CGEISGJJZDGKSH-FCHUYYIVSA-N
Molecular Weight 369.480 g/mol
SMILES C1N(CC[C@]([C@@]1(C(=O)OCC(C)C)[H])(c1ccc(cc1)F)[H])Cc1ccccc1
SPLASH splash10-0006-9661000000-130f0b162d84f35f4319
Source of Spectrum U1-2002-3550-16
Synonyms (3S,4R)-1-benzyl-4-(4-fluorophenyl)nipecotic acid isobutyl ester (3S,4R)-4-(4-fluorophenyl)-1-(phenylmethyl)-3-piperidinecarboxylic acid 2-methylpropyl ester 2-Methylpropyl (3S,4R)-1-benzyl-4-(4-fluorophenyl)piperidine-3-carboxylate 2-Methylpropyl (3S,4R)-4-(4-fluorophenyl)-1-(phenylmethyl)piperidine-3-carboxylate
Wiley ID 1523342