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1-[2-(4-Fluorophenyl)ethyl]piperidin-4-yl-4-methyl benzoate
SpectraBase Compound ID JglaEAFSxAt
InChI InChI=1S/C21H24FNO2/c1-16-2-6-18(7-3-16)21(24)25-20-11-14-23(15-12-20)13-10-17-4-8-19(22)9-5-17/h2-9,20H,10-15H2,1H3
InChIKey NYPGFGRJLPPMGM-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 GXV56GfhTYO
Name 1-[2-(4-Fluorophenyl)ethyl]piperidin-4-yl-4-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/c1-16-2-6-18(7-3-16)21(24)25-20-11-14-23(15-12-20)13-10-17-4-8-19(22)9-5-17/h2-9,20H,10-15H2,1H3
InChIKey NYPGFGRJLPPMGM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 341.426 g/mol
Nominal Mass 341 u
Quality 994
Retention Index 2990
SMILES C(C1=CC=C(C=C1)C)(OC1CCN(CC1)CCC=1C=CC(=CC1)F)=O
SPLASH splash10-00lr-2790000000-01ee3d1268b8c7c3fa21
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_029158