| SpectraBase Compound ID | 3NZIUkuzptu |
|---|---|
| InChI | InChI=1S/C21H26O2/c1-2-3-4-5-6-8-11-18-14-16-20(17-15-18)23-21(22)19-12-9-7-10-13-19/h7,9-10,12-17H,2-6,8,11H2,1H3 |
| InChIKey | LLHITUVSWAXSSA-UHFFFAOYSA-N |
| Mol Weight | 310.44 g/mol |
| Molecular Formula | C21H26O2 |
| Exact Mass | 310.19328 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Kz6lzMoX1EJ |
|---|---|
| Name | benzoic acid (4-octylphenyl) ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H26O2 |
| InChI | InChI=1S/C21H26O2/c1-2-3-4-5-6-8-11-18-14-16-20(17-15-18)23-21(22)19-12-9-7-10-13-19/h7,9-10,12-17H,2-6,8,11H2,1H3 |
| InChIKey | LLHITUVSWAXSSA-UHFFFAOYSA-N |
| Molecular Weight | 310.437 g/mol |
| SMILES | C(Oc1ccc(cc1)CCCCCCCC)(=O)c1ccccc1 |
| SPLASH | splash10-0a4i-2940000000-7400734527cbbb54a330 |
| Source of Spectrum | IC-892-0-0 |
| Wiley ID | 1312034 |