| SpectraBase Spectrum ID |
CjQYVvWa8Bu |
| Name |
1-[5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl] 4-methyl 2-hydroxy-2,3,3-trimethylbutandioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H36O5 |
| InChI |
InChI=1S/C24H36O5/c1-16-13-14-18(22(2,3)17-11-9-8-10-12-17)19(15-16)29-21(26)24(6,27)23(4,5)20(25)28-7/h8-12,16,18-19,27H,13-15H2,1-7H3/t16-,18-,19-,24-/m1/s1 |
| InChIKey |
LCBFSBRWAGSZCU-VEBYGKHWSA-N |
| Molecular Weight |
404.547 g/mol |
| SMILES |
O[C@@](C(C(=O)OC)(C)C)(C(O[C@]1([C@](C(c2ccccc2)(C)C)(CC[C@](C1)(C)[H])[H])[H])=O)C |
| SPLASH |
splash10-014i-0900000000-267c8925e5fb1adfebb8 |
| Source of Spectrum |
KC-1993-1739-15 |
| Synonyms |
(S)-2-Hydroxy-2,3,3-trimethyl-succinic acid 4-methyl ester 1-[(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)-cyclohexyl]ester
4-methyl 1-[5-methyl-2-(1-methyl-1-phenylethyl)cyclohexyl]2-hydroxy-2,3,3-trimethylsuccinate |
| Wiley ID |
778424 |
![1-[5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl] 4-methyl 2-hydroxy-2,3,3-trimethylbutandioate](/api/spectrum/CjQYVvWa8Bu/structure.png?h=300&w=458 "1-[5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl] 4-methyl 2-hydroxy-2,3,3-trimethylbutandioate")
