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2-[10-(3,5-dichlorophenyl)-2,4-diketo-benzo[g]pteridin-3-yl]acetic acid ethyl ester
SpectraBase Compound ID 9FNWPAj2A91
InChI InChI=1S/C20H14Cl2N4O4/c1-2-30-16(27)10-25-19(28)17-18(24-20(25)29)26(13-8-11(21)7-12(22)9-13)15-6-4-3-5-14(15)23-17/h3-9H,2,10H2,1H3
InChIKey PTJZKMICSYYFNC-UHFFFAOYSA-N
Mol Weight 445.26 g/mol
Molecular Formula C20H14Cl2N4O4
Exact Mass 444.03921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJRuLNxGPtV
Name 2-[10-(3,5-dichlorophenyl)-2,4-diketo-benzo[g]pteridin-3-yl]acetic acid ethyl ester
Alternate Name(s) 2-[10-(3,5-dichlorophenyl)-2,4-dioxo-3-benzo[g]pteridinyl]acetic acid ethyl ester Ethyl 2-[10-(3,5-dichlorophenyl)-2,4-dioxo-benzo[g]pteridin-3-yl]acetate Ethyl 2-[10-[3,5-bis(chloranyl)phenyl]-2,4-bis(oxidanylidene)benzo[g]pteridin-3-yl]ethanoate
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Formula C20H14Cl2N4O4
InChI InChI=1S/C20H14Cl2N4O4/c1-2-30-16(27)10-25-19(28)17-18(24-20(25)29)26(13-8-11(21)7-12(22)9-13)15-6-4-3-5-14(15)23-17/h3-9H,2,10H2,1H3
InChIKey PTJZKMICSYYFNC-UHFFFAOYSA-N
Molecular Weight 445.262 g/mol
SMILES C1=2C(C(=O)N(C(N2)=O)CC(=O)OCC)=Nc2c(N1c1cc(Cl)cc(c1)Cl)cccc2
SPLASH splash10-00di-0009200000-d1f65fea2989eb56ae80
Source of Spectrum U-1995-1279-9
Wiley ID 767229