| SpectraBase Spectrum ID |
CPB8LlEWa5F |
| Name |
[1,1':4',1''-Tercyclohexane]-4-carboxylic acid, 4''-propyl-, butyl ester, [trans[trans(trans)]]- |
| CAS Registry Number |
101630-62-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H46O2 |
| InChI |
InChI=1S/C26H46O2/c1-3-5-19-28-26(27)25-17-15-24(16-18-25)23-13-11-22(12-14-23)21-9-7-20(6-4-2)8-10-21/h20-25H,3-19H2,1-2H3/t20-,21?,22?,23?,24?,25- |
| InChIKey |
NQUGBSMVJUDYAZ-GGEMAANSSA-N |
| Molecular Weight |
390.652 g/mol |
| SMILES |
C(C1CCC(CC1)C1CCC(CC1)C1CCC(CC1)CCC)(=O)OCCCC |
| SPLASH |
splash10-0006-0009000000-dd39d74be05510c28a4f |
| Source of Spectrum |
K-119-398-19 |
| Synonyms |
butyl 4-[4-(4-propylcyclohexyl)cyclohexyl]cyclohexane-1-carboxylate
trans-4-[trans-4-(trans-4-propylcyclohexy)cyclohexyl]cyclohexancarbonsaure-butylester
[1,1':4',1''-tercyclohexane]-4-carboxylic acid, 4''-propyl-, butyl ester, [trans[trans(trans)]]- |
| Wiley ID |
1365172 |
![[1,1':4',1''-Tercyclohexane]-4-carboxylic acid, 4''-propyl-, butyl ester, [trans[trans(trans)]]-](/api/spectrum/CPB8LlEWa5F/structure.png?h=300&w=458 "[1,1':4',1''-Tercyclohexane]-4-carboxylic acid, 4''-propyl-, butyl ester, [trans[trans(trans)]]-")
