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2,7,7-trimethyl-4-(2-methylsulfonylethyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester
SpectraBase Compound ID 9iRwZQy4fSq
InChI InChI=1S/C17H25NO5S/c1-10-14(16(20)23-4)11(6-7-24(5,21)22)15-12(18-10)8-17(2,3)9-13(15)19/h11,18H,6-9H2,1-5H3
InChIKey IUZRGROEGGHUAC-UHFFFAOYSA-N
Mol Weight 355.45 g/mol
Molecular Formula C17H25NO5S
Exact Mass 355.145344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4SLivqOHy7
Name 2,7,7-trimethyl-4-(2-methylsulfonylethyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester
Alternate Name(s) 5-keto-4-(2-mesylethyl)-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Methyl 2,7,7-trimethyl-4-(2-methylsulfonylethyl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate Methyl 2,7,7-trimethyl-4-(2-methylsulfonylethyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
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Formula C17H25NO5S
InChI InChI=1S/C17H25NO5S/c1-10-14(16(20)23-4)11(6-7-24(5,21)22)15-12(18-10)8-17(2,3)9-13(15)19/h11,18H,6-9H2,1-5H3
InChIKey IUZRGROEGGHUAC-UHFFFAOYSA-N
Molecular Weight 355.449 g/mol
SMILES N1C(=C(C(C=2C(CC(CC12)(C)C)=O)CCS(=O)(=O)C)C(=O)OC)C
SPLASH splash10-0592-0059000000-bc610b3d04b4d8391ed9
Source of Spectrum Y4-89-734-3
Wiley ID 1550358