| SpectraBase Spectrum ID |
CWRDQKfkxh3 |
| Name |
1-[3,5-Bis(ethoxycarbonyl)-1H-pyrazol-1-yl]-3-[5-ethoxycarbonyl-3-(8-hydroxy-3,6-dioxaoctyloxycarbonyl)-1H-pyrazol-1-yl]propane |
| Alternate Name(s) |
5-ethyl 3-{2-[2-(2-hydroxyethoxy)ethoxy]ethyl} 1-{3-[3,5-bis(ethoxycarbonyl)-1H-pyrazol-1-yl]propyl}-1H-pyrazole-3,5-dicarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H36N4O11 |
| InChI |
InChI=1S/C25H36N4O11/c1-4-37-22(31)18-16-20(24(33)38-5-2)28(26-18)8-7-9-29-21(25(34)39-6-3)17-19(27-29)23(32)40-15-14-36-13-12-35-11-10-30/h16-17,30H,4-15H2,1-3H3 |
| InChIKey |
WWKRDFUMGBAQBT-UHFFFAOYSA-N |
| Molecular Weight |
568.580 g/mol |
| SMILES |
OCCOCCOCCOC(c1cc([n](n1)CCC[n]1c(cc(n1)C(=O)OCC)C(=O)OCC)C(=O)OCC)=O |
| SPLASH |
splash10-0udi-0090020000-da9ff3c4f3b8d1c2ae9a |
| Source of Spectrum |
F-53-11487-2 |
| Wiley ID |
803460 |
![1-[3,5-Bis(ethoxycarbonyl)-1H-pyrazol-1-yl]-3-[5-ethoxycarbonyl-3-(8-hydroxy-3,6-dioxaoctyloxycarbonyl)-1H-pyrazol-1-yl]propane](/api/spectrum/CWRDQKfkxh3/structure.png?h=300&w=458 "1-[3,5-Bis(ethoxycarbonyl)-1H-pyrazol-1-yl]-3-[5-ethoxycarbonyl-3-(8-hydroxy-3,6-dioxaoctyloxycarbonyl)-1H-pyrazol-1-yl]propane")
