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7-(ethylthio)-9-hydroxy-3-methyl-benz[g]isoquinoline-5,10-quinone
SpectraBase Compound ID 8WQaVMub3vZ
InChI InChI=1S/C16H13NO3S/c1-3-21-9-5-11-14(13(18)6-9)16(20)12-7-17-8(2)4-10(12)15(11)19/h4-7,18H,3H2,1-2H3
InChIKey XVIHIJNLKQRTDM-UHFFFAOYSA-N
Mol Weight 299.34 g/mol
Molecular Formula C16H13NO3S
Exact Mass 299.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8h98q3uVIjM
Name 7-(ethylthio)-9-hydroxy-3-methyl-benz[g]isoquinoline-5,10-quinone
Alternate Name(s) 7-(ethylthio)-9-hydroxy-3-methylbenzo[g]isoquinoline-5,10-dione 7-Ethylsulfanyl-3-methyl-9-oxidanyl-benzo[g]isoquinoline-5,10-dione 7-Ethylsulfanyl-9-hydroxy-3-methylbenzo[g]isoquinoline-5,10-dione
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Formula C16H13NO3S
InChI InChI=1S/C16H13NO3S/c1-3-21-9-5-11-14(13(18)6-9)16(20)12-7-17-8(2)4-10(12)15(11)19/h4-7,18H,3H2,1-2H3
InChIKey XVIHIJNLKQRTDM-UHFFFAOYSA-N
Molecular Weight 299.344 g/mol
SMILES Oc1c2c(C(c3cc(ncc3C2=O)C)=O)cc(c1)SCC
SPLASH splash10-0002-0091000000-f2dda71dd789c0e49965
Source of Spectrum J-65-644-28
Wiley ID 1531996