| SpectraBase Spectrum ID |
B13QSndBNRY |
| Name |
Pimelic acid, 2,3,6-trichlorophenyl octyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H29Cl3O4 |
| InChI |
InChI=1S/C21H29Cl3O4/c1-2-3-4-5-6-10-15-27-18(25)11-8-7-9-12-19(26)28-21-17(23)14-13-16(22)20(21)24/h13-14H,2-12,15H2,1H3 |
| InChIKey |
RLSABXPJNVKETC-UHFFFAOYSA-N |
| Molecular Weight |
451.818 g/mol |
| SMILES |
C(CCCCCC(Oc1c(c(ccc1Cl)Cl)Cl)=O)(OCCCCCCCC)=O |
| SPLASH |
splash10-054o-9810000000-abf538a747359759753b |
| Source of Spectrum |
TIPS-2022-588-0 |
| Wiley ID |
1822105 |
