SpectraBase Spectrum ID |
87iAFnPy8Ub |
Name |
4-(1-(4-cyanophenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)benzoic acid |
Appearance |
Yellow crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
367.132076797 u |
Formula |
C23H17N3O2 |
InChI |
InChI=1S/C23H17N3O2/c24-15-16-6-12-20(13-7-16)26-22(18-4-2-1-3-5-18)14-21(25-26)17-8-10-19(11-9-17)23(27)28/h1-13,22H,14H2,(H,27,28) |
InChIKey |
KEFUGQSMZDVLEZ-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202101892 |
Molecular Weight |
367.408 g/mol |
SMILES |
OC(C1=CC=C(C2=NN(C3=CC=C(C#N)C=C3)C(C2)C2=CC=CC=C2)C=C1)=O |
SPLASH |
splash10-015c-0906000000-7fe0a0b737e167fa0c26 |
Source of Spectrum |
QE-27-SM13-5b (DOI: 10.1002/chem.202101892) |
Wiley ID |
1904096 |