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Methyl 3-methoxy-2-(perfluoro-1-butanesulfonyloxy)benzoate
SpectraBase Compound ID 2i6YEwZC1Vw
InChI InChI=1S/C13H9F9O6S/c1-26-7-5-3-4-6(9(23)27-2)8(7)28-29(24,25)13(21,22)11(16,17)10(14,15)12(18,19)20/h3-5H,1-2H3
InChIKey ROXAIDJCACHLAD-UHFFFAOYSA-N
Mol Weight 464.25 g/mol
Molecular Formula C13H9F9O6S
Exact Mass 463.997613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gg6Jvs3z4Ss
Name Methyl 3-methoxy-2-(perfluoro-1-butanesulfonyloxy)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9F9O6S
InChI InChI=1S/C13H9F9O6S/c1-26-7-5-3-4-6(9(23)27-2)8(7)28-29(24,25)13(21,22)11(16,17)10(14,15)12(18,19)20/h3-5H,1-2H3
InChIKey ROXAIDJCACHLAD-UHFFFAOYSA-N
Molecular Weight 464.255 g/mol
SMILES C(S(Oc1c(C(=O)OC)cccc1OC)(=O)=O)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-001j-2900000000-c253eb3bc0426e929ebd
Source of Spectrum F-56-2539-9
Synonyms Methyl 3-methoxy-2-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyloxy)benzoate Methyl 3-methoxy-2-[1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butylsulfonyloxy]benzoate
Wiley ID 856600