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4-bromo-3,5-dimethylphenyl fluorosulfate
SpectraBase Compound ID C7ORAOlVnYl
InChI InChI=1S/C8H8BrFO3S/c1-5-3-7(13-14(10,11)12)4-6(2)8(5)9/h3-4H,1-2H3
InChIKey WCTPKPRLDPUNGI-UHFFFAOYSA-N
Mol Weight 283.11 g/mol
Molecular Formula C8H8BrFO3S
Exact Mass 281.936156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3quYlNDuQi
Name 4-bromo-3,5-dimethylphenyl fluorosulfate
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8BrFO3S
InChI InChI=1S/C8H8BrFO3S/c1-5-3-7(13-14(10,11)12)4-6(2)8(5)9/h3-4H,1-2H3
InChIKey WCTPKPRLDPUNGI-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5975-7820A
Ionization Type EI
Literature Reference DOI 10.1002/anie.201911465
Molecular Weight 283.111 g/mol
Reported Formula C8H8(79)BrFO3(32)S
SMILES c1(c(c(cc(c1)OS(F)(=O)=O)C)Br)C
SPLASH splash10-00ec-4970000000-2cf7ca2baca7f70e01bf
Source of Spectrum ACI-59-SM7-7-1
Thin-Layer Chromatography Rf = 0.53 (pentane)
Wiley ID 1856896