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 |