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2,4-Dimethoxybenzoic acid 2-[3,5-bis(trifluoromethyl)phenyl]sulfonylethyl ester
SpectraBase Compound ID 2CY5kC08t0t
InChI InChI=1S/C19H16F6O6S/c1-29-13-3-4-15(16(10-13)30-2)17(26)31-5-6-32(27,28)14-8-11(18(20,21)22)7-12(9-14)19(23,24)25/h3-4,7-10H,5-6H2,1-2H3
InChIKey QCHWMJOTOQXWEV-UHFFFAOYSA-N
Mol Weight 486.38 g/mol
Molecular Formula C19H16F6O6S
Exact Mass 486.057178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59OMGgAolIm
Name 2,4-Dimethoxybenzoic acid 2-[3,5-bis(trifluoromethyl)phenyl]sulfonylethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16F6O6S
InChI InChI=1S/C19H16F6O6S/c1-29-13-3-4-15(16(10-13)30-2)17(26)31-5-6-32(27,28)14-8-11(18(20,21)22)7-12(9-14)19(23,24)25/h3-4,7-10H,5-6H2,1-2H3
InChIKey QCHWMJOTOQXWEV-UHFFFAOYSA-N
Molecular Weight 486.381 g/mol
SMILES C(c1c(cc(cc1)OC)OC)(=O)OCCS(=O)(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
SPLASH splash10-01p9-0900000000-d5f346313c85ac94593f
Source of Spectrum CV-2003-285-4
Wiley ID 1610772