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methyl 2-(2,6-dimethylphenyl)sulfanyl-2-phenyl-acetate
SpectraBase Compound ID 1Zpv0a3BFR5
InChI InChI=1S/C17H18O2S/c1-12-8-7-9-13(2)15(12)20-16(17(18)19-3)14-10-5-4-6-11-14/h4-11,16H,1-3H3
InChIKey FSKINQQUIAHDCD-UHFFFAOYSA-N
Mol Weight 286.39 g/mol
Molecular Formula C17H18O2S
Exact Mass 286.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSgp0BTSXKh
Name methyl 2-(2,6-dimethylphenyl)sulfanyl-2-phenyl-acetate
Appearance Oil
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Exact Mass 286.102750992 u
Formula C17H18O2S
InChI InChI=1S/C17H18O2S/c1-12-8-7-9-13(2)15(12)20-16(17(18)19-3)14-10-5-4-6-11-14/h4-11,16H,1-3H3
InChIKey FSKINQQUIAHDCD-UHFFFAOYSA-N
Instrument Name VG ZAB-HS
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.210
Quality 329
Reported Formula C17H18O2S
SMILES C1=CC=C(C=C1)C(C(=O)OC)SC1=C(C=CC=C1C)C
SPLASH splash10-0077-7950000000-4bad4d2aa38eb35954cd
Source of Spectrum ARK-2003-89-89-4 (DOI: 10.3998/ark.5550190.0004.210)
Wiley ID 1901065