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Benzo[g]pteridine-2,4(3H,10H)-dione, 7-(bromoacetyl)-10-methyl-
SpectraBase Compound ID 16cLQXBdz5g
InChI InChI=1S/C13H9BrN4O3/c1-18-8-3-2-6(9(19)5-14)4-7(8)15-10-11(18)16-13(21)17-12(10)20/h2-4H,5H2,1H3,(H,17,20,21)
InChIKey DIWFKGOVCWGKNH-UHFFFAOYSA-N
Mol Weight 349.14 g/mol
Molecular Formula C13H9BrN4O3
Exact Mass 347.985803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXXvXA2gyQ1
Name Benzo[g]pteridine-2,4(3H,10H)-dione, 7-(bromoacetyl)-10-methyl-
CAS Registry Number 68973-54-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9BrN4O3
InChI InChI=1S/C13H9BrN4O3/c1-18-8-3-2-6(9(19)5-14)4-7(8)15-10-11(18)16-13(21)17-12(10)20/h2-4H,5H2,1H3,(H,17,20,21)
InChIKey DIWFKGOVCWGKNH-UHFFFAOYSA-N
Molecular Weight 349.144 g/mol
SMILES N1C(C=2C(=NC1=O)N(c1c(N2)cc(cc1)C(=O)CBr)C)=O
SPLASH splash10-00lr-9500000000-e5c9962e66bc13c4e6ad
Source of Spectrum F-46-944-8
Synonyms 7-(2-bromanylethanoyl)-10-methyl-benzo[g]pteridine-2,4-dione 7-(2-bromo-1-oxoethyl)-10-methylbenzo[g]pteridine-2,4-dione 7-(2-bromoacetyl)-10-methyl-benzo[g]pteridine-2,4-dione 7-(2-bromoacetyl)-10-methyl-benzo[g]pteridine-2,4-quinone
Wiley ID 1340264