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4-(Isobutylsulfinyl)-2,5-dimethylphenol
SpectraBase Compound ID GQeOENPunHL
InChI InChI=1S/C12H18O2S/c1-8(2)7-15(14)12-6-9(3)11(13)5-10(12)4/h5-6,8,13H,7H2,1-4H3
InChIKey PUGWZKBXAGSBGM-UHFFFAOYSA-N
Mol Weight 226.33 g/mol
Molecular Formula C12H18O2S
Exact Mass 226.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8PazEQ7Na92
Name 4-(Isobutylsulfinyl)-2,5-dimethylphenol
Alternate Name(s) 2,5-Dimethyl-4-(2-methylpropylsulfinyl)phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2S
InChI InChI=1S/C12H18O2S/c1-8(2)7-15(14)12-6-9(3)11(13)5-10(12)4/h5-6,8,13H,7H2,1-4H3
InChIKey PUGWZKBXAGSBGM-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo2006335
Molecular Weight 226.334 g/mol
SMILES Oc1cc(c(cc1C)S(CC(C)C)=O)C
SPLASH splash10-00di-0910000000-e14e4b1f24e3e02d5395
Source of Spectrum J-76-4642-20d
Wiley ID 1744836