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N-[1-[2-(3,4-dimethylphenoxy)ethylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide
SpectraBase Compound ID 4l5x84jvIV5
InChI InChI=1S/C22H28N2O3S/c1-16-9-10-19(15-17(16)2)27-13-12-23-22(26)20(11-14-28-3)24-21(25)18-7-5-4-6-8-18/h4-10,15,20H,11-14H2,1-3H3,(H,23,26)(H,24,25)
InChIKey GVSRJCCCPXQTHG-UHFFFAOYSA-N
Mol Weight 400.54 g/mol
Molecular Formula C22H28N2O3S
Exact Mass 400.182064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4VbaY4xkqt
Name N-[1-[2-(3,4-dimethylphenoxy)ethylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide
Alternate Name(s) N-[1-[2-(3,4-dimethylphenoxy)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide N-[1-[2-(3,4-dimethylphenoxy)ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide N-[1-[2-(3,4-dimethylphenoxy)ethylcarbamoyl]-3-(methylthio)propyl]benzamide N-[1-[2-(3,4-dimethylphenoxy)ethylcarbamoyl]-3-methylsulfanyl-propyl]benzamide
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Formula C22H28N2O3S
InChI InChI=1S/C22H28N2O3S/c1-16-9-10-19(15-17(16)2)27-13-12-23-22(26)20(11-14-28-3)24-21(25)18-7-5-4-6-8-18/h4-10,15,20H,11-14H2,1-3H3,(H,23,26)(H,24,25)
InChIKey GVSRJCCCPXQTHG-UHFFFAOYSA-N
Molecular Weight 400.537 g/mol
SMILES N(C(C(CCSC)NC(=O)c1ccccc1)=O)CCOc1ccc(c(c1)C)C
SPLASH splash10-0a6r-7920000000-335ec70f9a4c24fd46ef
Wiley ID 1444268