SpectraBase Spectrum ID |
1Z1mQuUhwye |
Name |
Pimelic acid, 4-methylcyclohexyl dodecyl ester isomer 1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H48O4 |
InChI |
InChI=1S/C26H48O4/c1-3-4-5-6-7-8-9-10-11-15-22-29-25(27)16-13-12-14-17-26(28)30-24-20-18-23(2)19-21-24/h23-24H,3-22H2,1-2H3 |
InChIKey |
UQMPOQHSZVTPSK-UHFFFAOYSA-N |
Molecular Weight |
424.666 g/mol |
SMILES |
C(CCCCCC(OC1CCC(CC1)C)=O)(OCCCCCCCCCCCC)=O |
SPLASH |
splash10-0006-9701000000-2bbfd675b9ffe8ff762d |
Source of Spectrum |
TIPS-2022-512-0 |
Wiley ID |
1822029 |