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3,4-Dimethylcyclohexyl 4-(1,3-benzothiazol-2-ylamino)-4-oxobutanoate
SpectraBase Compound ID 7Mvr0qKMSuJ
InChI InChI=1S/C19H24N2O3S/c1-12-7-8-14(11-13(12)2)24-18(23)10-9-17(22)21-19-20-15-5-3-4-6-16(15)25-19/h3-6,12-14H,7-11H2,1-2H3,(H,20,21,22)
InChIKey LCVNWZHECOZDNA-UHFFFAOYSA-N
Mol Weight 360.47 g/mol
Molecular Formula C19H24N2O3S
Exact Mass 360.150764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GE30ubStCif
Name 3,4-Dimethylcyclohexyl 4-(1,3-benzothiazol-2-ylamino)-4-oxobutanoate
Alternate Name(s) (3,4-dimethylcyclohexyl) 4-(1,3-benzothiazol-2-ylamino)-4-oxidanylidene-butanoate 4-(1,3-benzothiazol-2-ylamino)-4-keto-butyric acid (3,4-dimethylcyclohexyl) ester 4-(1,3-benzothiazol-2-ylamino)-4-oxobutanoic acid (3,4-dimethylcyclohexyl) ester Succinamic acid, N-(benzothiazol-2-yl)-, 3,4-dimethylcyclohexyl ester (3,4-dimethylcyclohexyl) 4-(1,3-benzothiazol-2-ylamino)-4-oxobutanoate
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Formula C19H24N2O3S
InChI InChI=1S/C19H24N2O3S/c1-12-7-8-14(11-13(12)2)24-18(23)10-9-17(22)21-19-20-15-5-3-4-6-16(15)25-19/h3-6,12-14H,7-11H2,1-2H3,(H,20,21,22)
InChIKey LCVNWZHECOZDNA-UHFFFAOYSA-N
Molecular Weight 360.472 g/mol
SMILES N(c1nc2ccccc2s1)C(=O)CCC(OC1CC(C)C(CC1)C)=O
SPLASH splash10-0udi-4900000000-1d584728f36896c97991
Source of Spectrum AD-0-2532-0
Wiley ID 1436096