| SpectraBase Compound ID | 8waKVDykHYa |
|---|---|
| InChI | InChI=1S/C23H36O4/c1-14(2)17-10-8-15(3)12-20(17)27-21(25)23(7,26)18-11-9-16(13-19(18)24)22(4,5)6/h9,11,13-15,17,20,24,26H,8,10,12H2,1-7H3/t15?,17?,20?,23-/m0/s1 |
| InChIKey | DDEJADSGERCOQW-RSRSJRJESA-N |
| Mol Weight | 376.5 g/mol |
| Molecular Formula | C23H36O4 |
| Exact Mass | 376.26136 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CRHwAJhLMSX |
|---|---|
| Name | (2S)-2-hydroxy-2-(2-hydroxy-4-tert-butylphenyl)propanoic acid (-)-menthyl ester |
| Alternate Name(s) | 2-isopropyl-5-methylcyclohexyl (2S)-2-(4-tert-butyl-2-hydroxyphenyl)-2-hydroxypropanoate |
| CAS Registry Number | 100993-14-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H36O4 |
| InChI | InChI=1S/C23H36O4/c1-14(2)17-10-8-15(3)12-20(17)27-21(25)23(7,26)18-11-9-16(13-19(18)24)22(4,5)6/h9,11,13-15,17,20,24,26H,8,10,12H2,1-7H3/t15?,17?,20?,23-/m0/s1 |
| InChIKey | DDEJADSGERCOQW-RSRSJRJESA-N |
| Molecular Weight | 376.537 g/mol |
| SMILES | Oc1c([C@@](C(OC2C(CCC(C2)C)C(C)C)=O)(O)C)ccc(c1)C(C)(C)C |
| SPLASH | splash10-0006-0911000000-50d07677065214cbb5db |
| Source of Spectrum | J-53-1783-5 |
| Wiley ID | 1357971 |