SpectraBase Spectrum ID |
2GchuFCMoho |
Name |
2-(2-(5-Oxo-2-phenyl-2,5-dihydro-1H-1,2,4-triazol-3-yl)phenyl)isoindoline-1,3-dione |
Appearance |
Yellow crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H14N4O3 |
InChI |
InChI=1S/C22H14N4O3/c27-20-15-10-4-5-11-16(15)21(28)25(20)18-13-7-6-12-17(18)19-23-22(29)24-26(19)14-8-2-1-3-9-14/h1-13H,(H,24,29) |
InChIKey |
LDMJPXHDINCEJJ-UHFFFAOYSA-N |
Instrument Name |
Kratos Model MS 25 (Magnetic Sector) or HP Model MS-5988 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/jhet.2287 |
Molecular Weight |
382.379 g/mol |
SMILES |
N1N(C(=NC1=O)c1c(N2C(c3c(cccc3)C2=O)=O)cccc1)c1ccccc1 |
SPLASH |
splash10-004l-9244000000-73a6e551c38f1b205e45 |
Source of Spectrum |
Y-53-491-17 |
Wiley ID |
1877615 |