| SpectraBase Spectrum ID |
HeTGPceFJCU |
| Name |
1-{trans-4-[3-Fluoro-4-(phenylthio)butyl]cyclohexyl}-trans-4-(pentyl)cyclohexane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H43FS |
| InChI |
InChI=1S/C27H43FS/c1-2-3-5-8-22-11-16-24(17-12-22)25-18-13-23(14-19-25)15-20-26(28)21-29-27-9-6-4-7-10-27/h4,6-7,9-10,22-26H,2-3,5,8,11-21H2,1H3/t22?,23-,24?,25-,26? |
| InChIKey |
XUZNQBMLBIMEES-NIIKTVIUSA-N |
| Molecular Weight |
418.699 g/mol |
| SMILES |
[C@]1(C2CCC(CC2)CCCCC)(CC[C@](CC1)(CCC(CSc1ccccc1)F)[H])[H] |
| SPLASH |
splash10-02u0-9800200000-c5e13db058b619d85671 |
| Source of Spectrum |
AJ-73-1639-3 |
| Synonyms |
({2-fluoro-4-[4-(4-pentylcyclohexyl)cyclohexyl]butyl}sulfanyl)benzene
1-{trans-4-(3-Fluoro-4-(phenylthio)butyl]cyclohexyl}-trans-4-(pentyl)cyclohexane
1-{trans-4-[3-Fluoro-4-(phenylthio)butyl)cyclohexyl}-trans-4-(pentenyl)cyclohexane |
| Wiley ID |
775513 |
![1-{trans-4-[3-Fluoro-4-(phenylthio)butyl]cyclohexyl}-trans-4-(pentyl)cyclohexane](/api/spectrum/HeTGPceFJCU/structure.png?h=300&w=458 "1-{trans-4-[3-Fluoro-4-(phenylthio)butyl]cyclohexyl}-trans-4-(pentyl)cyclohexane")
