SpectraBase Spectrum ID |
7uuCYIwVEmx |
Name |
Pimelic acid, 2-(tert-butyl)cyclohexyl methyl ester isomer 1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H32O4 |
InChI |
InChI=1S/C18H32O4/c1-18(2,3)14-10-8-9-11-15(14)22-17(20)13-7-5-6-12-16(19)21-4/h14-15H,5-13H2,1-4H3 |
InChIKey |
KDYJIMVVENXLNK-UHFFFAOYSA-N |
Molecular Weight |
312.450 g/mol |
SMILES |
C(CCCCCC(OC1C(CCCC1)C(C)(C)C)=O)(OC)=O |
SPLASH |
splash10-0a4i-7900000000-14d2bc64a978884b3f6a |
Source of Spectrum |
TIPS-2022-654-0 |
Wiley ID |
1822171 |