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3-(Carboxymethyl)-6-methoxyphenyl Trifluoromethanesulfonate
SpectraBase Compound ID L5w6jhWHF7M
InChI InChI=1S/C10H9F3O6S/c1-18-7-3-2-6(5-9(14)15)4-8(7)19-20(16,17)10(11,12)13/h2-4H,5H2,1H3,(H,14,15)
InChIKey NUOCOSZIMCTERT-UHFFFAOYSA-N
Mol Weight 314.23 g/mol
Molecular Formula C10H9F3O6S
Exact Mass 314.007194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Qao0mWgVO5
Name 3-(Carboxymethyl)-6-methoxyphenyl Trifluoromethanesulfonate
Alternate Name(s) (4-methoxy-3-{[(trifluoromethyl)sulfonyl]oxy}phenyl)acetic acid
CAS Registry Number 132338-45-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9F3O6S
InChI InChI=1S/C10H9F3O6S/c1-18-7-3-2-6(5-9(14)15)4-8(7)19-20(16,17)10(11,12)13/h2-4H,5H2,1H3,(H,14,15)
InChIKey NUOCOSZIMCTERT-UHFFFAOYSA-N
Molecular Weight 314.231 g/mol
SMILES OC(Cc1cc(OS(C(F)(F)F)(=O)=O)c(cc1)OC)=O
SPLASH splash10-001j-1901000000-95029967db5d1d9c9cbb
Source of Spectrum J-57-682-21
Wiley ID 1314582