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1-(4-Fluorophenyl)propane-1,2-dione
SpectraBase Compound ID 2INKtiSzAtB
InChI InChI=1S/C9H7FO2/c1-6(11)9(12)7-2-4-8(10)5-3-7/h2-5H,1H3
InChIKey SUYYALHDOSIMTI-UHFFFAOYSA-N
Mol Weight 166.15 g/mol
Molecular Formula C9H7FO2
Exact Mass 166.043008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVpNClJR8nA
Name 1-(4-Fluorophenyl)-1,2-propanedione
Classification Cathinone analog designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 166.043007626 u
Formula C9H7FO2
InChI InChI=1S/C9H7FO2/c1-6(11)9(12)7-2-4-8(10)5-3-7/h2-5H,1H3
InChIKey SUYYALHDOSIMTI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 166.151 g/mol
Nominal Mass 166 u
Quality 989
Retention Index 1120
SMILES C(C(C1=CC=C(C=C1)F)=O)(=O)C
SPLASH splash10-00dj-7900000000-62a88be065dbe4973496
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(4-Fluorophenyl)-2-oxopropan-1-one 1-(4-fluorophenyl)propane-1,2-dione
Technique GC/MS
Wiley ID DD2024_012451