| SpectraBase Compound ID | LtwyLFgVuOv |
|---|---|
| InChI | InChI=1S/C19H29BrO4/c1-14-15(12-10-8-6-4-5-7-9-11-13-20)17(22)19(24-3)18(23-2)16(14)21/h4-13H2,1-3H3 |
| InChIKey | MBHYAQKIMZZCCX-UHFFFAOYSA-N |
| Mol Weight | 401.34 g/mol |
| Molecular Formula | C19H29BrO4 |
| Exact Mass | 400.124922 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FgiT39HzQCb |
|---|---|
| Name | Bromoidebenone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H29BrO4 |
| InChI | InChI=1S/C19H29BrO4/c1-14-15(12-10-8-6-4-5-7-9-11-13-20)17(22)19(24-3)18(23-2)16(14)21/h4-13H2,1-3H3 |
| InChIKey | MBHYAQKIMZZCCX-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 401.341 g/mol |
| SMILES | C=1(C(C(=C(C(C1OC)=O)C)CCCCCCCCCCBr)=O)OC |
| SPLASH | splash10-0f6t-3900300000-c683014e358246c8d7ba |
| Source of Spectrum | CN114716296A |
| Wiley ID | 1884349 |