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(4-Methylsulfanylphenyl)carbamic acid, 2,3,5-trimethylphenyl ester
SpectraBase Compound ID 5ZelwLqkoPW
InChI InChI=1S/C17H19NO2S/c1-11-9-12(2)13(3)16(10-11)20-17(19)18-14-5-7-15(21-4)8-6-14/h5-10H,1-4H3,(H,18,19)
InChIKey QJTPIHJTJJOCRO-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 2Cbi15cu3sm
Name (4-Methylsulfanylphenyl)carbamic acid, 2,3,5-trimethylphenyl ester
Alternate Name(s) (2,3,5-trimethylphenyl) N-(4-methylsulfanylphenyl)carbamate N-[4-(methylthio)phenyl]carbamic acid (2,3,5-trimethylphenyl) ester
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Formula C17H19NO2S
InChI InChI=1S/C17H19NO2S/c1-11-9-12(2)13(3)16(10-11)20-17(19)18-14-5-7-15(21-4)8-6-14/h5-10H,1-4H3,(H,18,19)
InChIKey QJTPIHJTJJOCRO-UHFFFAOYSA-N
Molecular Weight 301.404 g/mol
SMILES N(C(Oc1c(c(C)cc(c1)C)C)=O)c1ccc(cc1)SC
SPLASH splash10-00ri-3900000000-7bf922b38c1f3eb93ce7
Wiley ID 1436878