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2-Bromo-4-(hydroxymethyl)-6-methoxyphenyl Trifluoromethanesulfonate
SpectraBase Compound ID 7Y7b4KNBZfH
InChI InChI=1S/C9H8BrF3O5S/c1-17-7-3-5(4-14)2-6(10)8(7)18-19(15,16)9(11,12)13/h2-3,14H,4H2,1H3
InChIKey VMRBIGCUYVXCSJ-UHFFFAOYSA-N
Mol Weight 365.12 g/mol
Molecular Formula C9H8BrF3O5S
Exact Mass 363.922792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LyMbshU3TO
Name 2-Bromo-4-(hydroxymethyl)-6-methoxyphenyl Trifluoromethanesulfonate
CAS Registry Number 137898-17-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8BrF3O5S
InChI InChI=1S/C9H8BrF3O5S/c1-17-7-3-5(4-14)2-6(10)8(7)18-19(15,16)9(11,12)13/h2-3,14H,4H2,1H3
InChIKey VMRBIGCUYVXCSJ-UHFFFAOYSA-N
Molecular Weight 365.117 g/mol
SMILES OCc1cc(c(OS(C(F)(F)F)(=O)=O)c(c1)Br)OC
SPLASH splash10-001j-9572000000-298a4f8c98323ccbb2f0
Source of Spectrum J-57-682-27
Wiley ID 1350437