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2-Amino-4-methyl-8H-pyrimido[4,5-d]pyrimidin-5-one

View entire compound with spectra: 1 MS (GC)

2-Amino-4-methyl-8H-pyrimido[4,5-d]pyrimidin-5-one
SpectraBase Compound ID 6pkqQs2VZn0
InChI InChI=1S/C7H7N5O/c1-3-4-5(12-7(8)11-3)9-2-10-6(4)13/h2H,1H3,(H3,8,9,10,11,12,13)
InChIKey IHBRZPGDVLXXOG-UHFFFAOYSA-N
Mol Weight 177.17 g/mol
Molecular Formula C7H7N5O
Exact Mass 177.06506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PSAn4NXNVa
Name 2-Amino-4-methyl-8H-pyrimido[4,5-d]pyrimidin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7N5O
InChI InChI=1S/C7H7N5O/c1-3-4-5(12-7(8)11-3)9-2-10-6(4)13/h2H,1H3,(H3,8,9,10,11,12,13)
InChIKey IHBRZPGDVLXXOG-UHFFFAOYSA-N
Molecular Weight 177.167 g/mol
SMILES Nc1nc2N=CNC(c2c(n1)C)=O
SPLASH splash10-004i-0900000000-f7d782e6c19f9db5f5f7
Source of Spectrum F9-1991-163-0
Synonyms 2-Azanyl-4-methyl-8H-pyrimido[4,5-d]pyrimidin-5-one
Wiley ID 1566353