| SpectraBase Spectrum ID |
Ki0hdoCO79T |
| Name |
3-[2-Hydroxyphenyl]-5-{4'-[3""""-(2""""'-hydroxyphenyl)-2""""-pyrazolin-5""""-yl]phenyl}-2-pyrazoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.174275962 u |
| Formula |
C24H22N4O2 |
| InChI |
InChI=1S/C24H22N4O2/c29-19-5-3-4-18(14-19)28-23(12-13-25-28)17-10-8-16(9-11-17)21-15-22(27-26-21)20-6-1-2-7-24(20)30/h1-11,13-14,21,23,26,29-30H,12,15H2 |
| InChIKey |
IPTHOPWKFFAMFC-UHFFFAOYSA-N |
| Molecular Weight |
398.466 g/mol |
| SMILES |
C1=NN(C(C1)C1=CC=C(C2NN=C(C2)C=2C(O)=CC=CC2)C=C1)C=1C=C(O)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930192 |
![3-[2-Hydroxyphenyl]-5-{4'-[3""""-(2""""'-hydroxyphenyl)-2""""-pyrazolin-5""""-yl]phenyl}-2-pyrazoline](/api/spectrum/Ki0hdoCO79T/structure.png?h=300&w=458 "3-[2-Hydroxyphenyl]-5-{4'-[3\"\"\"\"-(2\"\"\"\"'-hydroxyphenyl)-2\"\"\"\"-pyrazolin-5\"\"\"\"-yl]phenyl}-2-pyrazoline")
