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5-(1H-Benzimidazol-2-ylmethylene)-2,4,6(1H,3H,5H)-pyrimidinetrione

View entire compound with spectra: 1 MS (GC)

5-(1H-Benzimidazol-2-ylmethylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 5exXzGPPa5A
InChI InChI=1S/C12H8N4O3/c17-10-6(11(18)16-12(19)15-10)5-9-13-7-3-1-2-4-8(7)14-9/h1-5H,(H,13,14)(H2,15,16,17,18,19)
InChIKey CYYDUZKXIYOCGP-UHFFFAOYSA-N
Mol Weight 256.22 g/mol
Molecular Formula C12H8N4O3
Exact Mass 256.05964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A6fDaqfxYeu
Name 5-(1H-Benzimidazol-2-ylmethylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
Alternate Name(s) 5-(1H-benzimidazol-2-ylmethylene)barbituric acid 5-(1H-benzimidazol-2-ylmethylene)hexahydropyrimidine-2,4,6-trione 5-(1H-benzimidazol-2-ylmethylidene)-1,3-diazinane-2,4,6-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8N4O3
InChI InChI=1S/C12H8N4O3/c17-10-6(11(18)16-12(19)15-10)5-9-13-7-3-1-2-4-8(7)14-9/h1-5H,(H,13,14)(H2,15,16,17,18,19)
InChIKey CYYDUZKXIYOCGP-UHFFFAOYSA-N
Molecular Weight 256.221 g/mol
SMILES N1C(NC(C(=Cc2nc3ccccc3[nH]2)C1=O)=O)=O
SPLASH splash10-0a4i-1970000000-e36ae4a0eca5d7597f84
Wiley ID 1464815