SpectraBase Spectrum ID |
CxD9PXP1q33 |
Name |
Pimelic acid, 5-methoxy-3-phenylpentyl isobutyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H36O5 |
InChI |
InChI=1S/C23H36O5/c1-19(2)18-28-23(25)13-9-5-8-12-22(24)27-17-15-21(14-16-26-3)20-10-6-4-7-11-20/h4,6-7,10-11,19,21H,5,8-9,12-18H2,1-3H3 |
InChIKey |
QPTMGXLKYFUEEL-UHFFFAOYSA-N |
Molecular Weight |
392.536 g/mol |
SMILES |
C(CCCCCC(OCCC(CCOC)c1ccccc1)=O)(OCC(C)C)=O |
SPLASH |
splash10-002f-2900000000-4c7ddc91e11cb4907a17 |
Source of Spectrum |
TIPS-2022-912-0 |
Wiley ID |
1822429 |