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3-(4-Fluorophenyl)benzo[b]thiophene 1,1-dioxide
SpectraBase Compound ID 1Rx9NWTZrRt
InChI InChI=1S/C14H9FO2S/c15-11-7-5-10(6-8-11)13-9-18(16,17)14-4-2-1-3-12(13)14/h1-9H
InChIKey UDLISONFARXDBT-UHFFFAOYSA-N
Mol Weight 260.28 g/mol
Molecular Formula C14H9FO2S
Exact Mass 260.030729 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeDZsZ83IvR
Name 3-(4-Fluorophenyl)benzo[b]thiophene 1,1-dioxide
Appearance White crystalline solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 260.030728865 u
Formula C14H9FO2S
InChI InChI=1S/C14H9FO2S/c15-11-7-5-10(6-8-11)13-9-18(16,17)14-4-2-1-3-12(13)14/h1-9H
InChIKey UDLISONFARXDBT-UHFFFAOYSA-N
Instrument Name GCMSQP2010 SE
Ionization Type EI
Literature Reference DOI 10.1002/anie.201701409
Molecular Weight 260.282 g/mol
SMILES C1=CC2=C(C=C1)S(C=C2C1=CC=C(C=C1)F)(=O)=O
SPLASH splash10-001i-0090000000-2b73ac62fd1ee04755f7
Source of Spectrum ACI-56-SM12-1k (DOI: 10.1002/anie.201701409)
Thin-Layer Chromatography 0.29 (pentane/EtOAc, 75:25)
Wiley ID 1895774