SpectraBase Spectrum ID |
B2B4uFFxtKK |
Name |
cis-Cyclohex-4-en-1,2-dicarboxylic acid, 2,4,4-trimethylpentyl heptyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H40O4 |
InChI |
InChI=1S/C23H40O4/c1-6-7-8-9-12-15-26-21(24)19-13-10-11-14-20(19)22(25)27-17-18(2)16-23(3,4)5/h10-11,18-20H,6-9,12-17H2,1-5H3 |
InChIKey |
NAUMNIRVCYJRIT-UHFFFAOYSA-N |
Molecular Weight |
380.569 g/mol |
SMILES |
C1C(C(CC=C1)C(OCCCCCCC)=O)C(OCC(CC(C)(C)C)C)=O |
SPLASH |
splash10-0kmi-9510000000-4f50e86da7f0db1c8d71 |
Source of Spectrum |
TIPS-2023-888-0 |
Wiley ID |
1885594 |