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2-METHYLPHENYL-4-TOLUENESULFONATE
SpectraBase Compound ID F7C8syqksBB
InChI InChI=1S/C14H14O3S/c1-11-7-9-13(10-8-11)18(15,16)17-14-6-4-3-5-12(14)2/h3-10H,1-2H3
InChIKey WBKWVLAHWVFXKM-UHFFFAOYSA-N
Mol Weight 262.32 g/mol
Molecular Formula C14H14O3S
Exact Mass 262.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lhnzmy4t1rv
Name (2-methylphenyl) 4-methylbenzenesulfonate
Alternate Name(s) 4-Methylbenzenesulfonic acid (2-methylphenyl) ester 4-Methylbenzenesulfonic acid o-tolyl ester o-Tolyl 4-methylbenzenesulfonate
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Formula C14H14O3S
InChI InChI=1S/C14H14O3S/c1-11-7-9-13(10-8-11)18(15,16)17-14-6-4-3-5-12(14)2/h3-10H,1-2H3
InChIKey WBKWVLAHWVFXKM-UHFFFAOYSA-N
Molecular Weight 262.323 g/mol
SMILES c1(OS(c2ccc(cc2)C)(=O)=O)c(C)cccc1
SPLASH splash10-0006-9120000000-a4cd75ee98dd8ad4ea4a
Source of Spectrum IC-733-0-0
Wiley ID 1265651