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t-Butyl (R)-(+)-2-(p-Tolylsulfinyl)acetate
SpectraBase Compound ID DThwwjjEN4D
InChI InChI=1S/C13H18O3S/c1-10-5-7-11(8-6-10)17(15)9-12(14)16-13(2,3)4/h5-8H,9H2,1-4H3
InChIKey ATKQQTNXMNHRCW-UHFFFAOYSA-N
Mol Weight 254.34 g/mol
Molecular Formula C13H18O3S
Exact Mass 254.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AIq4BXAoRK
Name 2-[(S)-(4-methylphenyl)sulfinyl]acetic acid tert-butyl ester
Alternate Name(s) 2-[(S)-p-tolylsulfinyl]acetic acid tert-butyl ester tert-Butyl 2-[(S)-(4-methylphenyl)sulfinyl]acetate tert-Butyl 2-[(S)-(4-methylphenyl)sulfinyl]ethanoate tert-Butyl 2-[(S)-p-tolylsulfinyl]acetate
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Formula C13H18O3S
InChI InChI=1S/C13H18O3S/c1-10-5-7-11(8-6-10)17(15)9-12(14)16-13(2,3)4/h5-8H,9H2,1-4H3
InChIKey ATKQQTNXMNHRCW-UHFFFAOYSA-N
Molecular Weight 254.344 g/mol
SMILES C([S@@](c1ccc(cc1)C)=O)C(OC(C)(C)C)=O
SPLASH splash10-000i-2900000000-e7e09d57d26dcda29b07
Source of Spectrum AJ-68-3124-2
Wiley ID 773336