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4'-Methoxy-2-[4-(p-tolylethynyl)benzenesulfonyl]biphenyl
SpectraBase Compound ID HSdpUx43Ccc
InChI InChI=1S/C28H22O3S/c1-21-7-9-22(10-8-21)11-12-23-13-19-26(20-14-23)32(29,30)28-6-4-3-5-27(28)24-15-17-25(31-2)18-16-24/h3-10,13-20H,1-2H3
InChIKey SOXPSZGFAWBMON-UHFFFAOYSA-N
Mol Weight 438.54 g/mol
Molecular Formula C28H22O3S
Exact Mass 438.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6FtKutHsAqS
Name 4'-Methoxy-2-[4-(p-tolylethynyl)benzenesulfonyl]biphenyl
Alternate Name(s) 4'-methoxy-2-((4-(p-tolylethynyl)phenyl)sulfonyl)-1,1'-biphenyl
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Formula C28H22O3S
InChI InChI=1S/C28H22O3S/c1-21-7-9-22(10-8-21)11-12-23-13-19-26(20-14-23)32(29,30)28-6-4-3-5-27(28)24-15-17-25(31-2)18-16-24/h3-10,13-20H,1-2H3
InChIKey SOXPSZGFAWBMON-UHFFFAOYSA-N
Molecular Weight 438.541 g/mol
SMILES c1(c(cccc1)S(c1ccc(cc1)C#Cc1ccc(cc1)C)(=O)=O)-c1ccc(cc1)OC
SPLASH splash10-000i-0200900000-2051d457519cf6bea3e6
Source of Spectrum CCC-4-356/SM15-11d
Wiley ID 1788870