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N-(2,6-Dimethylphenyl)-3,5-dimethoxybenzothioamide
SpectraBase Compound ID CEcww7saXkD
InChI InChI=1S/C17H19NO2S/c1-11-6-5-7-12(2)16(11)18-17(21)13-8-14(19-3)10-15(9-13)20-4/h5-10H,1-4H3,(H,18,21)
InChIKey COAYZSDDYOHDFK-UHFFFAOYSA-N
Mol Weight 301.4 g/mol
Molecular Formula C17H19NO2S
Exact Mass 301.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FHsXKVStsRe
Name N-(2,6-Dimethylphenyl)-3,5-dimethoxybenzothioamide
Comments Less than 3 mono-isotopic peaks
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Formula C17H19NO2S
InChI InChI=1S/C17H19NO2S/c1-11-6-5-7-12(2)16(11)18-17(21)13-8-14(19-3)10-15(9-13)20-4/h5-10H,1-4H3,(H,18,21)
InChIKey COAYZSDDYOHDFK-UHFFFAOYSA-N
Molecular Weight 301.404 g/mol
SMILES N(C(c1cc(OC)cc(c1)OC)=S)c1c(cccc1C)C
SPLASH splash10-000i-0091000000-6bf52cc6d901246e028a
Source of Spectrum EJ-42-38-20
Synonyms N-(2,6-dimethylphenyl)-3,5-dimethoxybenzenecarbothioamide N-(2,6-dimethylphenyl)-3,5-dimethoxy-benzenecarbothioamide
Wiley ID 1676520