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S-(4-tolyl) 4-methoxybenzothioate
SpectraBase Compound ID EJpLtb9x6t4
InChI InChI=1S/C15H14O2S/c1-11-3-9-14(10-4-11)18-15(16)12-5-7-13(17-2)8-6-12/h3-10H,1-2H3
InChIKey OZSJZQZBUUDQQJ-UHFFFAOYSA-N
Mol Weight 258.33 g/mol
Molecular Formula C15H14O2S
Exact Mass 258.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6IrsbhAPauy
Name S-(4-tolyl) 4-methoxybenzothioate
Alternate Name(s) 4-methoxybenzenecarbothioic acid S-(4-methylphenyl) ester S-(p-tolyl) 4-methoxybenzenecarbothioate S-(4-methylphenyl) 4-methoxybenzenecarbothioate
Comments Less than 3 mono-isotopic peaks
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Formula C15H14O2S
InChI InChI=1S/C15H14O2S/c1-11-3-9-14(10-4-11)18-15(16)12-5-7-13(17-2)8-6-12/h3-10H,1-2H3
InChIKey OZSJZQZBUUDQQJ-UHFFFAOYSA-N
Molecular Weight 258.335 g/mol
SMILES C(Sc1ccc(cc1)C)(c1ccc(cc1)OC)=O
SPLASH splash10-000i-0900000000-582ad76fc7c30f373cea
Source of Spectrum F-67-7855-11
Wiley ID 1691275