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PHAITANTHRIN_B;6-HYDROXY-6-(METHOXYCARBONYL)-METHYLTRYPTANTHRIN
SpectraBase Compound ID BA54J2cwAli
InChI InChI=1S/C18H14N2O4/c1-24-15(21)10-18(23)12-7-3-5-9-14(12)20-16(22)11-6-2-4-8-13(11)19-17(18)20/h2-9,23H,10H2,1H3
InChIKey CGMNLIDQBYRXFP-UHFFFAOYSA-N
Mol Weight 322.32 g/mol
Molecular Formula C18H14N2O4
Exact Mass 322.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dpjcj2Heo0s
Name 6-Hydroxy-6-(methoxycarbonyl)-methyltryptanthrin
Alternate Name(s) Phaitanthrin B 2-(6-hydroxy-12-oxo-6-indolo[2,1-b]quinazolinyl)acetic acid methyl ester Methyl 2-(6-hydroxy-12-oxoindolo[2,1-b]quinazolin-6-yl)acetate Methyl 2-(6-hydroxy-12-oxo-indolo[2,1-b]quinazolin-6-yl)acetate Methyl 2-(6-oxidanyl-12-oxidanylidene-indolo[2,1-b]quinazolin-6-yl)ethanoate
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Formula C18H14N2O4
InChI InChI=1S/C18H14N2O4/c1-24-15(21)10-18(23)12-7-3-5-9-14(12)20-16(22)11-6-2-4-8-13(11)19-17(18)20/h2-9,23H,10H2,1H3
InChIKey CGMNLIDQBYRXFP-UHFFFAOYSA-N
Molecular Weight 322.320 g/mol
SMILES OC1(C=2N(C(c3c(cccc3)N2)=O)c2c1cccc2)CC(=O)OC
SPLASH splash10-0002-0091000000-6451507dd4239c55d500
Source of Spectrum G4-71-1278-2
Wiley ID 1695032