SpectraBase Spectrum ID |
B7U9LMzclUu |
Name |
Pimelic acid, 4-methylcyclohexyl nonyl ester isomer 1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H42O4 |
InChI |
InChI=1S/C23H42O4/c1-3-4-5-6-7-8-12-19-26-22(24)13-10-9-11-14-23(25)27-21-17-15-20(2)16-18-21/h20-21H,3-19H2,1-2H3 |
InChIKey |
MZQXXNSMGNWZPB-UHFFFAOYSA-N |
Molecular Weight |
382.585 g/mol |
SMILES |
C(CCCCCC(OC1CCC(CC1)C)=O)(OCCCCCCCCC)=O |
SPLASH |
splash10-0006-9710000000-0dcd01e6104a8bc7347a |
Source of Spectrum |
TIPS-2022-509-0 |
Wiley ID |
1822026 |