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(S)-1-[.alpha.-[(R)-2-(4-Chlorophenyl)piperidyl]benzyl]-2-naphthol
SpectraBase Compound ID 7z9n1BBmhPu
InChI InChI=1S/C28H26ClNO/c29-23-16-13-21(14-17-23)25-12-6-7-19-30(25)28(22-9-2-1-3-10-22)27-24-11-5-4-8-20(24)15-18-26(27)31/h1-5,8-11,13-18,25,28,31H,6-7,12,19H2/t25-,28+/m1/s1
InChIKey QHSCTVURQRBIJV-NAKRPHOHSA-N
Mol Weight 427.98 g/mol
Molecular Formula C28H26ClNO
Exact Mass 427.170292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HywKiDQOdfU
Name (S)-1-[.alpha.-[(R)-2-(4-Chlorophenyl)piperidyl]benzyl]-2-naphthol
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Formula C28H26ClNO
InChI InChI=1S/C28H26ClNO/c29-23-16-13-21(14-17-23)25-12-6-7-19-30(25)28(22-9-2-1-3-10-22)27-24-11-5-4-8-20(24)15-18-26(27)31/h1-5,8-11,13-18,25,28,31H,6-7,12,19H2/t25-,28+/m1/s1
InChIKey QHSCTVURQRBIJV-NAKRPHOHSA-N
Molecular Weight 427.975 g/mol
SMILES Oc1c([C@@](N2[C@@](c3ccc(cc3)Cl)(CCCC2)[H])(c2ccccc2)[H])c2c(cccc2)cc1
SPLASH splash10-001i-0091000000-09065aebbecac79ff199
Source of Spectrum KD-15-479-4
Synonyms 1-[(S)-[(2R)-2-(4-chlorophenyl)piperidinyl](phenyl)methyl]-2-naphthol
Wiley ID 1636736