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3'-Fluoro-2'-{(4-methylpyridin-2-yl)oxy}-[1,1'-biphenyl]-4-yl-4-methylbenzenesulfonate

View entire compound with spectra: 1 MS (GC)

3'-Fluoro-2'-{(4-methylpyridin-2-yl)oxy}-[1,1'-biphenyl]-4-yl-4-methylbenzenesulfonate
SpectraBase Compound ID Ju8LENncxHn
InChI InChI=1S/C25H20FNO4S/c1-17-6-12-21(13-7-17)32(28,29)31-20-10-8-19(9-11-20)22-4-3-5-23(26)25(22)30-24-16-18(2)14-15-27-24/h3-16H,1-2H3
InChIKey GERWXYBCZNWZHZ-UHFFFAOYSA-N
Mol Weight 449.5 g/mol
Molecular Formula C25H20FNO4S
Exact Mass 449.109707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ADyfpdnnqtO
Name 3'-Fluoro-2'-{(4-methylpyridin-2-yl)oxy}-[1,1'-biphenyl]-4-yl-4-methylbenzenesulfonate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20FNO4S
InChI InChI=1S/C25H20FNO4S/c1-17-6-12-21(13-7-17)32(28,29)31-20-10-8-19(9-11-20)22-4-3-5-23(26)25(22)30-24-16-18(2)14-15-27-24/h3-16H,1-2H3
InChIKey GERWXYBCZNWZHZ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol3000876
Molecular Weight 449.496 g/mol
SMILES c1(Oc2cc(ccn2)C)c(cccc1-c1ccc(OS(c2ccc(cc2)C)(=O)=O)cc1)F
SPLASH splash10-0006-3090000000-861b32b605caa892a4c5
Source of Spectrum A1-14-1154/SMS25-3he
Synonyms 3'-fluoro-2'-((4-methylpyridin-2-yl)oxy)-[1,1'-biphenyl]-4-yl 4-methylbenzenesulfonate
Wiley ID 1750111