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LEHPXNQRSYGBMX-UHFFFAOYSA-N
SpectraBase Compound ID A3Vuz2EtC44
InChI InChI=1S/C19H16N4O2/c1-2-25-18(24)16-12-15-13-22-11-7-6-10-17(22)23(15)19(21-16)20-14-8-4-3-5-9-14/h3-13H,2H2,1H3
InChIKey LEHPXNQRSYGBMX-UHFFFAOYSA-N
Mol Weight 332.36 g/mol
Molecular Formula C19H16N4O2
Exact Mass 332.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BckfNIVLV4c
Name Ethyl 1-(Phenylamino)-2,6,12-triazatricyclo[7.4.0(4a,12).0(6,11)]tridec-1,3,4a,7,9,11-hexaen-3-carboxylate zwitterion
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Formula C19H16N4O2
InChI InChI=1S/C19H16N4O2/c1-2-25-18(24)16-12-15-13-22-11-7-6-10-17(22)23(15)19(21-16)20-14-8-4-3-5-9-14/h3-13H,2H2,1H3
InChIKey LEHPXNQRSYGBMX-UHFFFAOYSA-N
Molecular Weight 332.363 g/mol
SMILES c1([n+]2c(cc(n1)C(=O)OCC)c[n]1c2C=CC=C1)[N-]c1ccccc1
SPLASH splash10-0a4i-0094000000-b01c1a6761dac6f166b8
Source of Spectrum J-59-6417-8
Synonyms 1-Phenylimino-3-pyrido[1,2]imidazo[3,5-c]pyrimidin-6-ium-2-idecarboxylic acid ethyl ester Ethyl 1-phenyliminopyrido[1,2]imidazo[3,5-c]pyrimidin-6-ium-2-ide-3-carboxylate
Wiley ID 1329445