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4-Fluoromethyl-phenyl-sulfoxide
SpectraBase Compound ID HuG3D1dVsmi
InChI InChI=1S/C7H7FOS/c1-10(9)7-4-2-6(8)3-5-7/h2-5H,1H3
InChIKey PQOHTVHAGPPTEE-UHFFFAOYSA-N
Mol Weight 158.19 g/mol
Molecular Formula C7H7FOS
Exact Mass 158.020164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKTtAeAAD5y
Name 1-fluoro-4-methylsulfinyl-benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 158.020164181 u
Formula C7H7FOS
GC Column DB-5 MS fused silica (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 220oC
InChI InChI=1S/C7H7FOS/c1-10(9)7-4-2-6(8)3-5-7/h2-5H,1H3
InChIKey PQOHTVHAGPPTEE-UHFFFAOYSA-N
Instrument Name Shimadzu GC-17A-QP5050A or Shimadzu GC-2010-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/chem.202102757
Molecular Weight 158.190 g/mol
Quality 924
SMILES C1(F)=CC=C(C=C1)S(=O)C
SPLASH splash10-0006-9800000000-8e47bb7e764bc53f15d0
Source of Spectrum QE-27-SM34-34-2 (DOI: 10.1002/chem.202102757)
Wiley ID 1904151