| SpectraBase Spectrum ID |
IQT5qDGcmv5 |
| Name |
Diethyl 3,3',4,4'-tetra(2-phenylethyl)dipyrromethane-5,5'-dicarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C47H50N2O4 |
| InChI |
InChI=1S/C47H50N2O4/c1-3-52-46(50)44-40(31-27-36-21-13-7-14-22-36)38(29-25-34-17-9-5-10-18-34)42(48-44)33-43-39(30-26-35-19-11-6-12-20-35)41(45(49-43)47(51)53-4-2)32-28-37-23-15-8-16-24-37/h5-24,48-49H,3-4,25-33H2,1-2H3 |
| InChIKey |
QNVQCPQXFXIQOW-UHFFFAOYSA-N |
| Molecular Weight |
706.927 g/mol |
| SMILES |
[nH]1c(c(c(c1Cc1c(c(c([nH]1)C(=O)OCC)CCc1ccccc1)CCc1ccccc1)CCc1ccccc1)CCc1ccccc1)C(=O)OCC |
| SPLASH |
splash10-0006-9000000000-55503a30aaa6e3ca31a4 |
| Source of Spectrum |
QB-20-138-2 |
| Wiley ID |
842188 |
