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2,6-bis(chloranyl)-N4,N8-bis(4-methoxyphenyl)pyrimido[5,4-d]pyrimidine-4,8-diamine
SpectraBase Compound ID 1NfBW2S4C3L
InChI InChI=1S/C20H16Cl2N6O2/c1-29-13-7-3-11(4-8-13)23-17-15-16(26-19(21)27-17)18(28-20(22)25-15)24-12-5-9-14(30-2)10-6-12/h3-10H,1-2H3,(H,23,26,27)(H,24,25,28)
InChIKey HJIKTQFBEVOHLS-UHFFFAOYSA-N
Mol Weight 443.29 g/mol
Molecular Formula C20H16Cl2N6O2
Exact Mass 442.071179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ujnRTwRyfS
Name 2,6-bis(chloranyl)-N4,N8-bis(4-methoxyphenyl)pyrimido[5,4-d]pyrimidine-4,8-diamine
Alternate Name(s) 2,6-dichloro-4-N,8-N-bis(4-methoxyphenyl)pyrimido[5,4-d]pyrimidine-4,8-diamine [2,6-dichloro-4-(p-anisidino)pyrimido[5,4-d]pyrimidin-8-yl]-(4-methoxyphenyl)amine
Comments Less than 3 mono-isotopic peaks
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Formula C20H16Cl2N6O2
InChI InChI=1S/C20H16Cl2N6O2/c1-29-13-7-3-11(4-8-13)23-17-15-16(26-19(21)27-17)18(28-20(22)25-15)24-12-5-9-14(30-2)10-6-12/h3-10H,1-2H3,(H,23,26,27)(H,24,25,28)
InChIKey HJIKTQFBEVOHLS-UHFFFAOYSA-N
Molecular Weight 443.294 g/mol
SMILES N(c1nc(nc2c(nc(nc12)Cl)Nc1ccc(cc1)OC)Cl)c1ccc(cc1)OC
SPLASH splash10-0006-0000900000-bcdbadeb6cf92a18d20e
Source of Spectrum K-2002-112-7
Wiley ID 1580580