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Benfluorex ME
SpectraBase Compound ID EtOfyWeZJKP
InChI InChI=1S/C20H22F3NO2/c1-15(13-16-7-6-10-18(14-16)20(21,22)23)24(2)11-12-26-19(25)17-8-4-3-5-9-17/h3-10,14-15H,11-13H2,1-2H3
InChIKey ADKGEPZRYHZWTO-UHFFFAOYSA-N
Mol Weight 365.4 g/mol
Molecular Formula C20H22F3NO2
Exact Mass 365.160263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J8uqbD7badM
Name Benfluorex ME
Classification Antilipemic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 365.160263439 u
Formula C20H22F3NO2
InChI InChI=1S/C20H22F3NO2/c1-15(13-16-7-6-10-18(14-16)20(21,22)23)24(2)11-12-26-19(25)17-8-4-3-5-9-17/h3-10,14-15H,11-13H2,1-2H3
InChIKey ADKGEPZRYHZWTO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 365.396 g/mol
SMILES C(c1cc(CC(N(CCOC(=O)c2ccccc2)C)C)ccc1)(F)(F)F
SPLASH splash10-0a4i-2950000000-3abfd15afad9b5d2c524
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_4708