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Benfluorex-M (-COOH) MEAC
SpectraBase Compound ID D2Fqa1gjFsv
InChI InChI=1S/C15H18F3NO3/c1-10(19(11(2)20)9-22-12(3)21)7-13-5-4-6-14(8-13)15(16,17)18/h4-6,8,10H,7,9H2,1-3H3
InChIKey ZIRJPSSAIYWJCL-UHFFFAOYSA-N
Mol Weight 317.31 g/mol
Molecular Formula C15H18F3NO3
Exact Mass 317.123878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G7oheDOCcfB
Name Benfluorex-M (-COOH) MEAC
Classification Antilipemic
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Exact Mass 317.123877930 u
Formula C15H18F3NO3
InChI InChI=1S/C15H18F3NO3/c1-10(19(11(2)20)9-22-12(3)21)7-13-5-4-6-14(8-13)15(16,17)18/h4-6,8,10H,7,9H2,1-3H3
InChIKey ZIRJPSSAIYWJCL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 317.308 g/mol
SMILES c1ccc(C(F)(F)F)cc1CC(N(COC(=O)C)C(=O)C)C
SPLASH splash10-066r-2900000000-74247f3e744ad070d24b
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.
Sample Preparation Procedure Detected: UHYAC
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_4711