SpectraBase Spectrum ID |
7qOd45gcfLE |
Name |
Pimelic acid, 4-(tert-butyl)cyclohexyl propyl ester isomer 2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H36O4 |
InChI |
InChI=1S/C20H36O4/c1-5-15-23-18(21)9-7-6-8-10-19(22)24-17-13-11-16(12-14-17)20(2,3)4/h16-17H,5-15H2,1-4H3 |
InChIKey |
YQXYAIVREMTFHA-UHFFFAOYSA-N |
Molecular Weight |
340.504 g/mol |
SMILES |
C(CCCCCC(OC1CCC(CC1)C(C)(C)C)=O)(OCCC)=O |
SPLASH |
splash10-052u-8900000000-a888e4b5d18653ae4a89 |
Source of Spectrum |
TIPS-2022-713-0 |
Wiley ID |
1822230 |