SpectraBase Compound ID | LAkF4huaDdZ |
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InChI | InChI=1S/C28H38O4/c1-18-12-15-22(28(5,6)19-10-8-7-9-11-19)24(16-18)32-26(31)25(30)21-14-13-20(17-23(21)29)27(2,3)4/h7-11,13-14,17-18,22,24-25,29-30H,12,15-16H2,1-6H3/t18?,22?,24?,25-/m0/s1 |
InChIKey | UMLLSAZSBMXECZ-RPRDLGQTSA-N |
Mol Weight | 438.6 g/mol |
Molecular Formula | C28H38O4 |
Exact Mass | 438.27701 g/mol |
SpectraBase Spectrum ID | LfiDAb75Avp |
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Name | (2S)-2-(2-Hydroxy-4-t-butylphenyl)-2-hydroxyethanoic acid (-)-8-phenylmenthyl ester |
Alternate Name(s) | 5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl (2S)-(4-tert-butyl-2-hydroxyphenyl)(hydroxy)ethanoate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C28H38O4 |
InChI | InChI=1S/C28H38O4/c1-18-12-15-22(28(5,6)19-10-8-7-9-11-19)24(16-18)32-26(31)25(30)21-14-13-20(17-23(21)29)27(2,3)4/h7-11,13-14,17-18,22,24-25,29-30H,12,15-16H2,1-6H3/t18?,22?,24?,25-/m0/s1 |
InChIKey | UMLLSAZSBMXECZ-RPRDLGQTSA-N |
Molecular Weight | 438.608 g/mol |
SMILES | O[C@@](c1c(cc(cc1)C(C)(C)C)O)(C(=O)OC1C(CCC(C1)C)C(C)(C)c1ccccc1)[H] |
SPLASH | splash10-0ar0-1910000000-e5396c0856a7ebbf6c00 |
Source of Spectrum | J-64-5008-3 |
Wiley ID | 1530647 |