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4-Amino-2,7-bis(dimethylamino)-5-[(1-benzyl-2-ethoxy-2-oxoethyl)amino]pyrimidino[4,5-d]pyrimidine
SpectraBase Compound ID CozmfFN6WAt
InChI InChI=1S/C21H28N8O2/c1-6-31-19(30)14(12-13-10-8-7-9-11-13)23-17-15-16(22)24-20(28(2)3)26-18(15)27-21(25-17)29(4)5/h7-11,14H,6,12H2,1-5H3,(H3,22,23,24,25,26,27)
InChIKey RUIWHZYGJLUKMA-UHFFFAOYSA-N
Mol Weight 424.51 g/mol
Molecular Formula C21H28N8O2
Exact Mass 424.233522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Al5X4Amjmq0
Name 4-Amino-2,7-bis(dimethylamino)-5-[(1-benzyl-2-ethoxy-2-oxoethyl)amino]pyrimidino[4,5-d]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N8O2
InChI InChI=1S/C21H28N8O2/c1-6-31-19(30)14(12-13-10-8-7-9-11-13)23-17-15-16(22)24-20(28(2)3)26-18(15)27-21(25-17)29(4)5/h7-11,14H,6,12H2,1-5H3,(H3,22,23,24,25,26,27)
InChIKey RUIWHZYGJLUKMA-UHFFFAOYSA-N
Molecular Weight 424.509 g/mol
SMILES N(c1c2c(nc(nc2N)N(C)C)nc(n1)N(C)C)C(C(=O)OCC)Cc1ccccc1
SPLASH splash10-022a-6492700000-c14399ae62e09269662c
Source of Spectrum F-54-9907-7
Synonyms Ethyl 2-{[5-amino-2,7-bis(dimethylamino)pyrimido[4,5-d]pyrimidin-4-yl]amino}-3-phenylpropanoate
Wiley ID 808387