| SpectraBase Spectrum ID |
5sOpF9FdQ1B |
| Name |
Pimelic acid, 4-(tert-butyl)cyclohexyl octyl ester isomer 2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H46O4 |
| InChI |
InChI=1S/C25H46O4/c1-5-6-7-8-9-13-20-28-23(26)14-11-10-12-15-24(27)29-22-18-16-21(17-19-22)25(2,3)4/h21-22H,5-20H2,1-4H3 |
| InChIKey |
PYVUIVNODBBXHP-UHFFFAOYSA-N |
| Molecular Weight |
410.639 g/mol |
| SMILES |
C(CCCCCC(OC1CCC(CC1)C(C)(C)C)=O)(OCCCCCCCC)=O |
| SPLASH |
splash10-0a4l-9630000000-d600fcf8de78a6e1d809 |
| Source of Spectrum |
TIPS-2022-720-0 |
| Wiley ID |
1822237 |
