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2-Isopropyl-5-methyl-4-(phenylsulfinyl)phenol
SpectraBase Compound ID 72PMZ0Q9c37
InChI InChI=1S/C16H18O2S/c1-11(2)14-10-16(12(3)9-15(14)17)19(18)13-7-5-4-6-8-13/h4-11,17H,1-3H3
InChIKey LAFMTAQUFKXVIB-UHFFFAOYSA-N
Mol Weight 274.38 g/mol
Molecular Formula C16H18O2S
Exact Mass 274.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GiZGxzjoBfx
Name 2-Isopropyl-5-methyl-4-(phenylsulfinyl)phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O2S
InChI InChI=1S/C16H18O2S/c1-11(2)14-10-16(12(3)9-15(14)17)19(18)13-7-5-4-6-8-13/h4-11,17H,1-3H3
InChIKey LAFMTAQUFKXVIB-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo2006335
Molecular Weight 274.378 g/mol
SMILES Oc1cc(C)c(cc1C(C)C)S(c1ccccc1)=O
SPLASH splash10-02mj-0690000000-b4edb2c483306d44be6f
Source of Spectrum J-76-4642-21a
Synonyms 4-(benzenesulfinyl)-5-methyl-2-propan-2-ylphenol 5-Methyl-4-(phenylsulfinyl)-2-propan-2-yl-phenol
Wiley ID 1744837