| SpectraBase Spectrum ID |
Gh0rAOBpnny |
| Name |
3,4-Bis-(1-phenyl-3-acetyl-pyrazol-4-carbonyl)-5-methyl-1 [4-(1-phenyl-3-acetyl-pyrazol-4-carbonyl)-phenyl]-pyrazole |
| Appearance |
Brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C46H34N8O6 |
| InChI |
InChI=1S/C46H34N8O6/c1-27-39(45(59)37-25-52(48-41(37)29(3)56)33-16-10-6-11-17-33)43(46(60)38-26-53(49-42(38)30(4)57)34-18-12-7-13-19-34)50-54(27)35-22-20-31(21-23-35)44(58)36-24-51(47-40(36)28(2)55)32-14-8-5-9-15-32/h5-26H,1-4H3 |
| InChIKey |
CQXDPJRFOCQXOZ-UHFFFAOYSA-N |
| Instrument Name |
AEI MS 30 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2644 |
| Molecular Weight |
794.828 g/mol |
| SMILES |
c1(n[n](c(c1C(=O)c1c(n[n](c1)-c1ccccc1)C(C)=O)C)-c1ccc(cc1)C(c1c[n](nc1C(C)=O)-c1ccccc1)=O)C(c1c[n](nc1C(C)=O)-c1ccccc1)=O |
| SPLASH |
splash10-00kk-2832206900-a0e31cea1b4a79cb2f47 |
| Source of Spectrum |
Y-54-702-7a |
| Wiley ID |
1877938 |
![3,4-Bis-(1-phenyl-3-acetyl-pyrazol-4-carbonyl)-5-methyl-1 [4-(1-phenyl-3-acetyl-pyrazol-4-carbonyl)-phenyl]-pyrazole](/api/spectrum/Gh0rAOBpnny/structure.png?h=300&w=458 "3,4-Bis-(1-phenyl-3-acetyl-pyrazol-4-carbonyl)-5-methyl-1 [4-(1-phenyl-3-acetyl-pyrazol-4-carbonyl)-phenyl]-pyrazole")
