| SpectraBase Compound ID | HR48DAyajSX |
|---|---|
| InChI | InChI=1S/C26H32O3/c1-3-29-25(28)23(24(27)21-15-9-5-10-16-21)26(2,22-17-11-6-12-18-22)19-20-13-7-4-8-14-20/h5-6,9-12,15-18,20,23H,3-4,7-8,13-14,19H2,1-2H3 |
| InChIKey | XYYHHJBTHVPUSH-UHFFFAOYSA-N |
| Mol Weight | 392.5 g/mol |
| Molecular Formula | C26H32O3 |
| Exact Mass | 392.235145 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HoOorqF3GN |
|---|---|
| Name | ethyl 2-benzoyl-4-cyclohexyl-3-methyl-3-phenyl-butanoate |
| Appearance | Pale yellow oily liquid |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H32O3 |
| InChI | InChI=1S/C26H32O3/c1-3-29-25(28)23(24(27)21-15-9-5-10-16-21)26(2,22-17-11-6-12-18-22)19-20-13-7-4-8-14-20/h5-6,9-12,15-18,20,23H,3-4,7-8,13-14,19H2,1-2H3 |
| InChIKey | XYYHHJBTHVPUSH-UHFFFAOYSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Molecular Weight | 392.539 g/mol |
| Reported Formula | C26H33O3 |
| SMILES | c1(C(C(C(OCC)=O)C(=O)c2ccccc2)(CC2CCCCC2)C)ccccc1 |
| SPLASH | splash10-0a4i-0930000000-fb2e75dc2cbcfb838853 |
| Sample Comments | dr = 1.1:1 |
| Source of Spectrum | CN108640839A |
| Wiley ID | 1872450 |