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2,7,7-trimethyl-4-[2-(methylthio)ethyl]-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester
SpectraBase Compound ID 5GrkBiKhaiz
InChI InChI=1S/C17H25NO3S/c1-10-14(16(20)21-4)11(6-7-22-5)15-12(18-10)8-17(2,3)9-13(15)19/h11,18H,6-9H2,1-5H3
InChIKey WLKLVGRSWBQDNM-UHFFFAOYSA-N
Mol Weight 323.45 g/mol
Molecular Formula C17H25NO3S
Exact Mass 323.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMF7m0bsTA6
Name 2,7,7-trimethyl-4-[2-(methylthio)ethyl]-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester
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Formula C17H25NO3S
InChI InChI=1S/C17H25NO3S/c1-10-14(16(20)21-4)11(6-7-22-5)15-12(18-10)8-17(2,3)9-13(15)19/h11,18H,6-9H2,1-5H3
InChIKey WLKLVGRSWBQDNM-UHFFFAOYSA-N
Molecular Weight 323.451 g/mol
SMILES N1C2=C(C(C(=C1C)C(=O)OC)CCSC)C(CC(C2)(C)C)=O
SPLASH splash10-0002-0093000000-3a794251de60d61a2127
Source of Spectrum Y4-89-732-1
Synonyms 5-keto-2,7,7-trimethyl-4-[2-(methylthio)ethyl]-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Methyl 2,7,7-trimethyl-4-(2-methylsulfanylethyl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate Methyl 2,7,7-trimethyl-4-(2-methylsulfanylethyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Wiley ID 1550361