| SpectraBase Spectrum ID |
LUw1G7Nq0KO |
| Name |
trans,trans-3,11-bis(trans-4'-Pentylcyclohexanoyl)dispiro[5.1.5.2]pentadecan-7-one |
| Alternate Name(s) |
7-oxo-11-{[(4-pentylcyclohexyl)carbonyl]oxy}dispiro[5.1.5.2]pentadec-3-yl 4-pentylcyclohexanecarboxylate |
| CAS Registry Number |
139564-62-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C39H64O5 |
| InChI |
InChI=1S/C39H64O5/c1-3-5-7-9-29-11-15-31(16-12-29)35(40)43-33-19-23-38(24-20-33)27-28-39(37(38)42)25-21-34(22-26-39)44-36(41)32-17-13-30(14-18-32)10-8-6-4-2/h29-34H,3-28H2,1-2H3/t29-,30-,31-,32-,33?,34?,38?,39? |
| InChIKey |
IQULJPDQBLGKTP-JXJGXATFSA-N |
| Molecular Weight |
612.936 g/mol |
| SMILES |
C1(C2(CCC11CCC(OC([C@]3(CC[C@@](CC3)(CCCCC)[H])[H])=O)CC1)CCC(OC([C@]1(CC[C@@](CC1)(CCCCC)[H])[H])=O)CC2)=O |
| SPLASH |
splash10-014i-0090000000-58001ea7701ce5854628 |
| Source of Spectrum |
K-125-1869-10 |
| Wiley ID |
1411093 |
![trans,trans-3,11-bis(trans-4'-Pentylcyclohexanoyl)dispiro[5.1.5.2]pentadecan-7-one](/api/spectrum/LUw1G7Nq0KO/structure.png?h=300&w=458 "trans,trans-3,11-bis(trans-4'-Pentylcyclohexanoyl)dispiro[5.1.5.2]pentadecan-7-one")
