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1-oxo-3-p-fluorophenyl-3,4-dihydrobenzo[4,5]imidazo[1,2-d][1,2,4]triazin-2(1H)-formic acid benzyl ester
SpectraBase Compound ID 7KHh8TkmooD
InChI InChI=1S/C23H17FN4O3/c24-17-10-12-18(13-11-17)26-14-21-25-19-8-4-5-9-20(19)27(21)22(29)28(26)23(30)31-15-16-6-2-1-3-7-16/h1-13H,14-15H2
InChIKey KYJCZRITISROOG-UHFFFAOYSA-N
Mol Weight 416.41 g/mol
Molecular Formula C23H17FN4O3
Exact Mass 416.128469 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D2M41YJxUmM
Name 1-oxo-3-p-fluorophenyl-3,4-dihydrobenzo[4,5]imidazo[1,2-d][1,2,4]triazin-2(1H)-formic acid benzyl ester
Appearance Light yellow powder
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Formula C23H17FN4O3
InChI InChI=1S/C23H17FN4O3/c24-17-10-12-18(13-11-17)26-14-21-25-19-8-4-5-9-20(19)27(21)22(29)28(26)23(30)31-15-16-6-2-1-3-7-16/h1-13H,14-15H2
InChIKey KYJCZRITISROOG-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 416.412 g/mol
SMILES c1cc2c(cc1)[n]1c(n2)CN(N(C1=O)C(OCc1ccccc1)=O)c1ccc(cc1)F
SPLASH splash10-0006-9111000000-a600186d5c508c338e70
Source of Spectrum CN110003213A
Wiley ID 1874884