SpectraBase Spectrum ID |
lOVJAqvlxg |
Name |
8,9-Difluoro-2-(4-nitrophenyl)-2H-benzo[4,5]imidazo[1,2-a]-[1,2,3]triazolo[4,5-e]pyrimidine |
Appearance |
Yellow powder |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H7F2N7O2 |
InChI |
InChI=1S/C16H7F2N7O2/c17-10-5-12-14(6-11(10)18)23-15-13(7-19-16(23)20-12)21-24(22-15)8-1-3-9(4-2-8)25(26)27/h1-7H |
InChIKey |
DGADACMHLNLEKC-UHFFFAOYSA-N |
Instrument Name |
Shimadzu GCMS-QP 2010 Ultra |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/acs.joc.1c00760 |
Molecular Weight |
367.276 g/mol |
SMILES |
c1(F)c(cc2c(nc3[n]2-c2c(C=N3)n[n](n2)-c2ccc(cc2)[N+]([O-])=O)c1)F |
SPLASH |
splash10-014i-6419000000-e50c35cb26d991ef6593 |
Source of Spectrum |
JOC-86-SM51-9e |
Thin-Layer Chromatography |
Rf = 0.4 (CHCl3) |
Wiley ID |
1867794 |