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1-[2-(4-Fluorophenyl)ethyl]piperidin-4-yl-3-methyl benzoate
SpectraBase Compound ID KOeHiLWrr7n
InChI InChI=1S/C21H24FNO2/c1-16-3-2-4-18(15-16)21(24)25-20-10-13-23(14-11-20)12-9-17-5-7-19(22)8-6-17/h2-8,15,20H,9-14H2,1H3
InChIKey VIDWMLFZALFIHL-UHFFFAOYSA-N
Mol Weight 341.43 g/mol
Molecular Formula C21H24FNO2
Exact Mass 341.179107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XdKJ7zjDpg
Name 1-[2-(4-Fluorophenyl)ethyl]piperidin-4-yl-3-methyl benzoate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 341.179107178 u
Formula C21H24FNO2
InChI InChI=1S/C21H24FNO2/c1-16-3-2-4-18(15-16)21(24)25-20-10-13-23(14-11-20)12-9-17-5-7-19(22)8-6-17/h2-8,15,20H,9-14H2,1H3
InChIKey VIDWMLFZALFIHL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 341.426 g/mol
Nominal Mass 341 u
Quality 1000
Retention Index 2970
SMILES C1(C(OC2CCN(CC2)CCC=2C=CC(=CC2)F)=O)=CC(=CC=C1)C
SPLASH splash10-00lr-2790000000-74e87688754a4a7bd497
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_029156