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1H-Imidazo[4,5-g]quinazoline-6,8(5H,7H)-dione
SpectraBase Compound ID gqcAyJQzGr
InChI InChI=1S/C9H6N4O2/c14-8-4-1-6-7(11-3-10-6)2-5(4)12-9(15)13-8/h1-3H,(H,10,11)(H2,12,13,14,15)
InChIKey OWGFEUREYVPVJR-UHFFFAOYSA-N
Mol Weight 202.17 g/mol
Molecular Formula C9H6N4O2
Exact Mass 202.049075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FHvKl2FZ5D
Name 1H-Imidazo[4,5-g]quinazoline-6,8(5H,7H)-dione
Alternate Name(s) LiN-benzoxanthine LiN-benzoxanthine (imidazo[4,5-g]quinazoline-6,8-(5H,7H)-dione 1,5-dihydroimidazo[4,5-g]quinazoline-6,8-dione
CAS Registry Number 60189-64-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6N4O2
InChI InChI=1S/C9H6N4O2/c14-8-4-1-6-7(11-3-10-6)2-5(4)12-9(15)13-8/h1-3H,(H,10,11)(H2,12,13,14,15)
InChIKey OWGFEUREYVPVJR-UHFFFAOYSA-N
Molecular Weight 202.173 g/mol
SMILES N1C(Nc2cc3nc[nH]c3cc2C1=O)=O
SPLASH splash10-0udi-0490000000-4f91f43ac9027b7b1a22
Source of Spectrum J-52-2934-6
Wiley ID 1199268