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2-Ethylsulfanylethyl 2-methyl-4-(6-methyl-4-oxidanylidene-chromen-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-Ethylsulfanylethyl 2-methyl-4-(6-methyl-4-oxidanylidene-chromen-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SpectraBase Compound ID 8s9WZPgZLka
InChI InChI=1S/C25H27NO5S/c1-4-32-11-10-30-25(29)21-15(3)26-18-6-5-7-19(27)23(18)22(21)17-13-31-20-9-8-14(2)12-16(20)24(17)28/h8-9,12-13,22,26H,4-7,10-11H2,1-3H3
InChIKey NQQNBVOUVCPSCY-UHFFFAOYSA-N
Mol Weight 453.55 g/mol
Molecular Formula C25H27NO5S
Exact Mass 453.160994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GeSGs0HEN95
Name 2-Ethylsulfanylethyl 2-methyl-4-(6-methyl-4-oxidanylidene-chromen-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
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Formula C25H27NO5S
InChI InChI=1S/C25H27NO5S/c1-4-32-11-10-30-25(29)21-15(3)26-18-6-5-7-19(27)23(18)22(21)17-13-31-20-9-8-14(2)12-16(20)24(17)28/h8-9,12-13,22,26H,4-7,10-11H2,1-3H3
InChIKey NQQNBVOUVCPSCY-UHFFFAOYSA-N
Molecular Weight 453.553 g/mol
SMILES N1C(=C(C(C2=C1CCCC2=O)C=1C(c2cc(C)ccc2OC1)=O)C(=O)OCCSCC)C
SPLASH splash10-00di-6769000000-f4e82c7d8c9cff49acfa
Synonyms 2-Ethylsulfanylethyl 2-methyl-4-(6-methyl-4-oxo-chromen-3-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate 2-Methyl-4-(6-methyl-4-oxo-1-benzopyran-3-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester 5-keto-4-(4-keto-6-methyl-chromen-3-yl)-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester
Wiley ID 1455295