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2'-Fluoropropiophenone
SpectraBase Compound ID EmHmXyfMiVs
InChI InChI=1S/C9H9FO/c1-2-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3
InChIKey NSNSIFGTEGKZFK-UHFFFAOYSA-N
Mol Weight 152.17 g/mol
Molecular Formula C9H9FO
Exact Mass 152.063743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JI26neFy8y8
Name 2'-Fluoropropiophenone
CAS Registry Number 446-22-0
Classification Designer drug precursor
Comments Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 152.063743072 u
Formula C9H9FO
InChI InChI=1S/C9H9FO/c1-2-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3
InChIKey NSNSIFGTEGKZFK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 152.168 g/mol
Nominal Mass 152 u
Quality 996
Retention Index 1103
SMILES C=1(C(=CC=CC1)F)C(CC)=O
SPLASH splash10-00di-3900000000-eeec45ce9e6e6f78a0e5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms o-Fluoropropiophenone 1-(2-Fluorophenyl)propan-1-one
Technique GC/MS
Wiley ID DD2024_024328