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Dimethyl 10-methyl-4-oxo-2-(phenylthio)-4,6,11,11a-tetrahydro-1H-pyrido[1,2-b]isoquinoline-7,8-dicarboxylate
SpectraBase Compound ID DKv8WTtkbJV
InChI InChI=1S/C24H23NO5S/c1-14-9-19(23(27)29-2)22(24(28)30-3)20-13-25-15(11-18(14)20)10-17(12-21(25)26)31-16-7-5-4-6-8-16/h4-9,12,15H,10-11,13H2,1-3H3
InChIKey PNUROUXBUPQJKN-UHFFFAOYSA-N
Mol Weight 437.51 g/mol
Molecular Formula C24H23NO5S
Exact Mass 437.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HyYvsEKOFj3
Name Dimethyl 10-methyl-4-oxo-2-(phenylthio)-4,6,11,11a-tetrahydro-1H-pyrido[1,2-b]isoquinoline-7,8-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C24H23NO5S
InChI InChI=1S/C24H23NO5S/c1-14-9-19(23(27)29-2)22(24(28)30-3)20-13-25-15(11-18(14)20)10-17(12-21(25)26)31-16-7-5-4-6-8-16/h4-9,12,15H,10-11,13H2,1-3H3
InChIKey PNUROUXBUPQJKN-UHFFFAOYSA-N
Molecular Weight 437.510 g/mol
SMILES C1(N2C(CC(=C1)Sc1ccccc1)Cc1c(C2)c(c(C(=O)OC)cc1C)C(=O)OC)=O
SPLASH splash10-000i-0000900000-d588b3262d5e4ff35c81
Source of Spectrum F-67-4510-13
Wiley ID 1686662