| SpectraBase Spectrum ID |
C0RfOtAnTtD |
| Name |
Toluene-4-sulfonic acid 2-[2-((1S,2S)-2-hydroxy-2,6,6-trimethyl-cyclohexyl)-ethyl]-3-oxo-butyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H34O5S |
| InChI |
InChI=1S/C22H34O5S/c1-16-7-10-19(11-8-16)28(25,26)27-15-18(17(2)23)9-12-20-21(3,4)13-6-14-22(20,5)24/h7-8,10-11,18,20,24H,6,9,12-15H2,1-5H3/t18?,20-,22-/m0/s1 |
| InChIKey |
XFNMUSPNDFCHID-KAOUJKNGSA-N |
| Molecular Weight |
410.569 g/mol |
| SMILES |
O[C@@]1([C@@](CCC(COS(c2ccc(cc2)C)(=O)=O)C(=O)C)(C(CCC1)(C)C)[H])C |
| SPLASH |
splash10-0006-9200000000-4e69da488b11afbb1b6a |
| Source of Spectrum |
MZ-34-194-16 |
| Synonyms |
2-[2'-(2''-Hydroxy-2'',6'',6''-trimethylcyclohexyl)ethyl]-3-oxobutyl p-methylbenzenesulfonate
4-Methylbenzenesulfonic acid[2-[2-[(1S,2S)-2-hydroxy-2,6,6-trimethyl-cyclohexyl]ethyl]-3-keto-butyl]ester
4-Methylbenzenesulfonic acid[2-[2-[(1S,2S)-2-hydroxy-2,6,6-trimethylcyclohexyl]ethyl]-3-oxobutyl]ester
[2-[2-[(1S,2S)-2-hydroxy-2,6,6-trimethyl-cyclohexyl]ethyl]-3-oxo-butyl]4-methylbenzenesulfonate
[3-oxidanylidene-2-[2-[(1S,6S)-2,2,6-trimethyl-6-oxidanyl-cyclohexyl]ethyl]butyl]4-methylbenzenesulfonate
4-Methylbenzenesulfonic acid [2-[2-[(1S,2S)-2-hydroxy-2,6,6-trimethylcyclohexyl]ethyl]-3-oxobutyl] ester
[2-[2-[(1S,2S)-2-hydroxy-2,6,6-trimethylcyclohexyl]ethyl]-3-oxobutyl] 4-methylbenzenesulfonate
[2-[2-[(1S,2S)-2-hydroxy-2,6,6-trimethyl-cyclohexyl]ethyl]-3-oxo-butyl] 4-methylbenzenesulfonate
[3-oxidanylidene-2-[2-[(1S,6S)-2,2,6-trimethyl-6-oxidanyl-cyclohexyl]ethyl]butyl] 4-methylbenzenesulfonate |
| Wiley ID |
1582069 |
![Toluene-4-sulfonic acid 2-[2-((1S,2S)-2-hydroxy-2,6,6-trimethyl-cyclohexyl)-ethyl]-3-oxo-butyl ester](/api/spectrum/C0RfOtAnTtD/structure.png?h=300&w=458 "Toluene-4-sulfonic acid 2-[2-((1S,2S)-2-hydroxy-2,6,6-trimethyl-cyclohexyl)-ethyl]-3-oxo-butyl ester")
