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4-Benzylamino-2,6,8-trichloropyrimidino[5,4-d]pyrimidine
SpectraBase Compound ID 4eqcmaWomqY
InChI InChI=1S/C13H8Cl3N5/c14-10-8-9(19-12(15)20-10)11(21-13(16)18-8)17-6-7-4-2-1-3-5-7/h1-5H,6H2,(H,17,18,21)
InChIKey XISHMDQEWBNNCE-UHFFFAOYSA-N
Mol Weight 340.6 g/mol
Molecular Formula C13H8Cl3N5
Exact Mass 338.984528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rgYgrgpIi1
Name 4-Benzylamino-2,6,8-trichloropyrimidino[5,4-d]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8Cl3N5
InChI InChI=1S/C13H8Cl3N5/c14-10-8-9(19-12(15)20-10)11(21-13(16)18-8)17-6-7-4-2-1-3-5-7/h1-5H,6H2,(H,17,18,21)
InChIKey XISHMDQEWBNNCE-UHFFFAOYSA-N
Molecular Weight 340.601 g/mol
SMILES N(c1nc(Cl)nc2c1nc(nc2Cl)Cl)Cc1ccccc1
SPLASH splash10-0006-3019000000-4d262804a7cd08481bc6
Source of Spectrum K-2002-112-8
Synonyms 2,4,6-trichloro-N-(phenylmethyl)-8-pyrimido[5,4-d]pyrimidinamine N-benzyl-2,4,6-trichloropyrimido[5,4-d]pyrimidin-8-amine N-benzyl-2,4,6-trichloro-pyrimido[5,4-d]pyrimidin-8-amine 2,4,6-tris(chloranyl)-N-(phenylmethyl)pyrimido[5,4-d]pyrimidin-8-amine
Wiley ID 1580581