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Flupentixol-M/artifact -C6H14N2O2
SpectraBase Compound ID NjS2HoN4SF
InChI InChI=1S/C17H11F3S/c1-2-5-12-13-6-3-4-7-15(13)21-16-9-8-11(10-14(12)16)17(18,19)20/h2-10H,1H2/b12-5-
InChIKey UIMQNVZBCXVRPK-XGICHPGQSA-N
Mol Weight 304.33 g/mol
Molecular Formula C17H11F3S
Exact Mass 304.053356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ztY1zrm9CR
Name Flupentixol-M/artifact -C6H14N2O2
Classification Neuroleptic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 304.053356017 u
Formula C17H11F3S
InChI InChI=1S/C17H11F3S/c1-2-5-12-13-6-3-4-7-15(13)21-16-9-8-11(10-14(12)16)17(18,19)20/h2-10H,1H2/b12-5-
InChIKey UIMQNVZBCXVRPK-XGICHPGQSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 304.330 g/mol
SMILES c1ccc2c(Sc3c(cc(cc3)C(F)(F)F)\C2=C\C=C)c1
SPLASH splash10-0udi-0296000000-f508e9c02abec7b07425
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
Synonyms Flupentixol-M/artifact (N-oxide) -C6H14N2O2
Technique GC/MS
Wiley ID MMPW6e_1891