| SpectraBase Spectrum ID |
9svSwLWecPA |
| Name |
Pimelic acid, 2-(tert-butyl)cyclohexyl butyl ester isomer 1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H38O4 |
| InChI |
InChI=1S/C21H38O4/c1-5-6-16-24-19(22)14-8-7-9-15-20(23)25-18-13-11-10-12-17(18)21(2,3)4/h17-18H,5-16H2,1-4H3 |
| InChIKey |
KNOYWTKLBIQHKT-UHFFFAOYSA-N |
| Molecular Weight |
354.531 g/mol |
| SMILES |
C(CCCCCC(OC1C(CCCC1)C(C)(C)C)=O)(OCCCC)=O |
| SPLASH |
splash10-05ow-8910000000-38963caf0ef57ba124a1 |
| Source of Spectrum |
TIPS-2022-658-0 |
| Wiley ID |
1822175 |
