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Pyrimido[5,4-d]pyrimidine, 2,4,6,8-tetrakis(m-chloroanilino)-
SpectraBase Compound ID C6cV1PTRxgM
InChI InChI=1S/C30H20Cl4N8/c31-17-5-1-9-21(13-17)35-27-25-26(40-29(41-27)37-23-11-3-7-19(33)15-23)28(36-22-10-2-6-18(32)14-22)42-30(39-25)38-24-12-4-8-20(34)16-24/h1-16H,(H2,35,37,40,41)(H2,36,38,39,42)
InChIKey XYYCLUIXATVNPW-UHFFFAOYSA-N
Mol Weight 634.4 g/mol
Molecular Formula C30H20Cl4N8
Exact Mass 632.056503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9h0qDIW8ymb
Name Pyrimido[5,4-d]pyrimidine, 2,4,6,8-tetrakis(m-chloroanilino)-
CAS Registry Number 18710-95-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H20Cl4N8
InChI InChI=1S/C30H20Cl4N8/c31-17-5-1-9-21(13-17)35-27-25-26(40-29(41-27)37-23-11-3-7-19(33)15-23)28(36-22-10-2-6-18(32)14-22)42-30(39-25)38-24-12-4-8-20(34)16-24/h1-16H,(H2,35,37,40,41)(H2,36,38,39,42)
InChIKey XYYCLUIXATVNPW-UHFFFAOYSA-N
Molecular Weight 634.358 g/mol
SMILES N(c1cccc(c1)Cl)c1c2c(nc(n1)Nc1cccc(c1)Cl)c(nc(n2)Nc1cccc(c1)Cl)Nc1cccc(c1)Cl
SPLASH splash10-001r-1200029000-6f8598fe5f7a0ef3680b
Source of Spectrum EP-7021-0-0
Synonyms (3-chlorophenyl)-[2,4,6-tris(3-chloroanilino)pyrimido[5,4-d]pyrimidin-8-yl]amine 2-N,4-N,6-N,8-N-tetrakis(3-chlorophenyl)pyrimido[5,4-d]pyrimidine-2,4,6,8-tetramine
Wiley ID 1412178