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3-(3,4-dimethylphenyl)-1-methyl-1-[2-(2-pyridinyl)ethyl]thiourea
SpectraBase Compound ID 4IhGu7h5OSa
InChI InChI=1S/C17H21N3S/c1-13-7-8-16(12-14(13)2)19-17(21)20(3)11-9-15-6-4-5-10-18-15/h4-8,10,12H,9,11H2,1-3H3,(H,19,21)
InChIKey AQMDSQRDCCTGAJ-UHFFFAOYSA-N
Mol Weight 299.44 g/mol
Molecular Formula C17H21N3S
Exact Mass 299.145619 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6TCFEV3oRfc
Name 3-(3,4-dimethylphenyl)-1-methyl-1-[2-(2-pyridinyl)ethyl]thiourea
Alternate Name(s) 3-(3,4-dimethylphenyl)-1-methyl-1-[2-(2-pyridyl)ethyl]thiourea N'-(3,4-dimethylphenyl)-N-methyl-N-[2-(2-pyridinyl)ethyl]thiourea
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Formula C17H21N3S
InChI InChI=1S/C17H21N3S/c1-13-7-8-16(12-14(13)2)19-17(21)20(3)11-9-15-6-4-5-10-18-15/h4-8,10,12H,9,11H2,1-3H3,(H,19,21)
InChIKey AQMDSQRDCCTGAJ-UHFFFAOYSA-N
Molecular Weight 299.436 g/mol
SMILES N(C(N(CCc1ncccc1)C)=S)c1cc(C)c(cc1)C
SPLASH splash10-01ox-9500000000-c2ca7e26688ae5257d81
Wiley ID 1511725