| SpectraBase Spectrum ID |
AloTn3bLBgL |
| Name |
1-(2-Chloroethyl)-3-((1,3-diphenyl-1H-pyrazol-4-yl)methylene)-5-phenyl-1H-pyrrol-2(3H)-one |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H22ClN3O |
| InChI |
InChI=1S/C28H22ClN3O/c29-16-17-31-26(21-10-4-1-5-11-21)19-23(28(31)33)18-24-20-32(25-14-8-3-9-15-25)30-27(24)22-12-6-2-7-13-22/h1-15,18-20H,16-17H2 |
| InChIKey |
AYMRKOUTYNWFPF-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GC-MS QP-1000EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2456 |
| Molecular Weight |
451.957 g/mol |
| SMILES |
C(Cl)CN1C(C(C=C1c1ccccc1)=Cc1c(n[n](c1)-c1ccccc1)-c1ccccc1)=O |
| SPLASH |
splash10-0a6r-8903100000-18ca2c4ac1ead6ada5fd |
| Source of Spectrum |
Y-53-1516-4b |
| Wiley ID |
1876624 |
