SpectraBase Spectrum ID |
Frc3lYuuSuJ |
Name |
Pimelic acid, 4-(tert-butyl)cyclohexyl undecyl ester isomer 2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H52O4 |
InChI |
InChI=1S/C28H52O4/c1-5-6-7-8-9-10-11-12-16-23-31-26(29)17-14-13-15-18-27(30)32-25-21-19-24(20-22-25)28(2,3)4/h24-25H,5-23H2,1-4H3 |
InChIKey |
ZUIFZKNNRCAAIC-UHFFFAOYSA-N |
Molecular Weight |
452.720 g/mol |
SMILES |
C(CCCCCC(OC1CCC(CC1)C(C)(C)C)=O)(OCCCCCCCCCCC)=O |
SPLASH |
splash10-052f-9610000000-d1615c04fe16b32b01e5 |
Source of Spectrum |
TIPS-2022-723-0 |
Wiley ID |
1822240 |