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10-(3',5'-Dichlorophenyl)-3-(methoxycarbonyl)isoalloxazine
SpectraBase Compound ID AeRvRaggVWq
InChI InChI=1S/C18H10Cl2N4O4/c1-28-18(27)24-16(25)14-15(22-17(24)26)23(11-7-9(19)6-10(20)8-11)13-5-3-2-4-12(13)21-14/h2-8H,1H3
InChIKey HFMFYOFPQISYIL-UHFFFAOYSA-N
Mol Weight 417.21 g/mol
Molecular Formula C18H10Cl2N4O4
Exact Mass 416.00791 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SpvdFUJt7J
Name 10-(3',5'-Dichlorophenyl)-3-(methoxycarbonyl)isoalloxazine
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Formula C18H10Cl2N4O4
InChI InChI=1S/C18H10Cl2N4O4/c1-28-18(27)24-16(25)14-15(22-17(24)26)23(11-7-9(19)6-10(20)8-11)13-5-3-2-4-12(13)21-14/h2-8H,1H3
InChIKey HFMFYOFPQISYIL-UHFFFAOYSA-N
Molecular Weight 417.208 g/mol
SMILES C=12C(=NC(N(C2=O)C(=O)OC)=O)N(c2cc(Cl)cc(c2)Cl)c2c(N1)cccc2
SPLASH splash10-00xr-0119000000-b9633e332610e019ef7b
Source of Spectrum U-1995-1279-2
Synonyms Methyl 10-(3,5-dichlorophenyl)-2,4-dioxo-4,10-dihydrobenzo[g]pteridine-3(2H)-carboxylate
Wiley ID 767225