| SpectraBase Spectrum ID |
Jscm1aXhdBA |
| Name |
(2S,3R) Ethyl 5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl 2-Hydroxy-2-methyl-3-pentynedioate |
| Alternate Name(s) |
1-Ethyl 5-[(1R,2R,5R)-5-methyl-2-(1-methyl-1-phenylethyl)cyclohexyl](4S)-4-hydroxy-4-methyl-2-pentynedioate |
| CAS Registry Number |
139944-73-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H32O5 |
| InChI |
InChI=1S/C24H32O5/c1-6-28-21(25)14-15-24(5,27)22(26)29-20-16-17(2)12-13-19(20)23(3,4)18-10-8-7-9-11-18/h7-11,17,19-20,27H,6,12-13,16H2,1-5H3/t17-,19?,20-,24+/m1/s1 |
| InChIKey |
FULPVROKIOZNRB-NMDPMABMSA-N |
| Molecular Weight |
400.515 g/mol |
| SMILES |
O[C@](C(O[C@]1(C(C(c2ccccc2)(C)C)CC[C@](C1)(C)[H])[H])=O)(C#CC(=O)OCC)C |
| SPLASH |
splash10-066r-0910000000-1148715bc1893e8a70db |
| Source of Spectrum |
J-57-2940-11 |
| Wiley ID |
1369551 |
