| SpectraBase Spectrum ID |
7i4VBhLq1zl |
| Name |
1-Cyclohexene-1-carboxylic acid, 2-(acetyloxy)-4-(4'-propyl[1,1'-bicyclohexyl]-4-yl)-, methyl ester, [trans(trans)]- |
| CAS Registry Number |
101630-64-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H40O4 |
| InChI |
InChI=1S/C25H40O4/c1-4-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)22-14-15-23(25(27)28-3)24(16-22)29-17(2)26/h18-22H,4-16H2,1-3H3 |
| InChIKey |
WOIGUKBKLCRBCI-UHFFFAOYSA-N |
| Molecular Weight |
404.591 g/mol |
| SMILES |
C1(=C(OC(=O)C)CC(CC1)C1CCC(CC1)C1CCC(CC1)CCC)C(=O)OC |
| SPLASH |
splash10-0006-0009000000-30f57e2bdfd0af5d2747 |
| Source of Spectrum |
K-119-398-22 |
| Synonyms |
2-Acetoxy-4-[trans-4(trans-4-propylcyclohexyl)cyclohexyl]-1-cyclohexen-1-carbonsaure-methylester
methyl 2-(acetyloxy)-4-[4-(4-propylcyclohexyl)cyclohexyl]cyclohex-1-ene-1-carboxylate |
| Wiley ID |
1371508 |
![1-Cyclohexene-1-carboxylic acid, 2-(acetyloxy)-4-(4'-propyl[1,1'-bicyclohexyl]-4-yl)-, methyl ester, [trans(trans)]-](/api/spectrum/7i4VBhLq1zl/structure.png?h=300&w=458 "1-Cyclohexene-1-carboxylic acid, 2-(acetyloxy)-4-(4'-propyl[1,1'-bicyclohexyl]-4-yl)-, methyl ester, [trans(trans)]-")
