SpectraBase Spectrum ID |
E3wQVMxnpjd |
Name |
5-(4-Bromobenzoyl)-6,8-dinitro-1-phenyl-1H-1,2,4-trazolo[5,1-a]isoindole |
Alternate Name(s) |
(4-bromophenyl)(6,8-dinitro-1-phenyl-1H-[1,2,4]triazolo[5,1-a]isoindol-5-yl)methanone |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H12BrN5O5 |
InChI |
InChI=1S/C22H12BrN5O5/c23-14-8-6-13(7-9-14)21(29)20-19-17(10-16(27(30)31)11-18(19)28(32)33)22-25(12-24-26(20)22)15-4-2-1-3-5-15/h1-12H |
InChIKey |
DVNSBUUANMVQFP-UHFFFAOYSA-N |
Molecular Weight |
506.272 g/mol |
SMILES |
c12[n](c(c3c(cc(cc23)N(=O)=O)N(=O)=O)C(c2ccc(cc2)Br)=O)N=CN1c1ccccc1 |
SPLASH |
splash10-08fr-9403030000-195c54e34380b702d10b |
Source of Spectrum |
H1-51-2218-7 |
Wiley ID |
817234 |