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(3S,4R,5S)-1-Benzyl-3-chloro-5-(chloromethyl)-4-(4-fluorophenyl)piperidine
SpectraBase Compound ID JRvRNt1YhTA
InChI InChI=1S/C19H20Cl2FN/c20-10-16-12-23(11-14-4-2-1-3-5-14)13-18(21)19(16)15-6-8-17(22)9-7-15/h1-9,16,18-19H,10-13H2/t16-,18-,19+/m1/s1
InChIKey FRLQLOJMOFTHNG-QRQLOZEOSA-N
Mol Weight 352.28 g/mol
Molecular Formula C19H20Cl2FN
Exact Mass 351.095683 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vQy8vTzpO3
Name (3S,4R,5S)-1-Benzyl-3-chloro-5-(chloromethyl)-4-(4-fluorophenyl)piperidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20Cl2FN
InChI InChI=1S/C19H20Cl2FN/c20-10-16-12-23(11-14-4-2-1-3-5-14)13-18(21)19(16)15-6-8-17(22)9-7-15/h1-9,16,18-19H,10-13H2/t16-,18-,19+/m1/s1
InChIKey FRLQLOJMOFTHNG-QRQLOZEOSA-N
Molecular Weight 352.280 g/mol
SMILES C1N(C[C@]([C@@]([C@@]1(Cl)[H])(c1ccc(cc1)F)[H])(CCl)[H])Cc1ccccc1
SPLASH splash10-00kf-6009000000-06dba85923ba519edc45
Source of Spectrum U1-2002-3548-8
Wiley ID 1523347