| SpectraBase Compound ID | 8sjeiCLAM9n |
|---|---|
| InChI | InChI=1S/C18H29BrO2/c1-2-3-4-5-6-8-15-20-17-10-12-18(13-11-17)21-16-9-7-14-19/h10-13H,2-9,14-16H2,1H3 |
| InChIKey | LFLAHHFVWNSFAS-UHFFFAOYSA-N |
| Mol Weight | 357.33 g/mol |
| Molecular Formula | C18H29BrO2 |
| Exact Mass | 356.135093 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 26SiP3Con3S |
|---|---|
| Name | 1-(4-Bromobutoxy)-4-(octyloxy)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 356.135093172 u |
| Formula | C18H29BrO2 |
| InChI | InChI=1S/C18H29BrO2/c1-2-3-4-5-6-8-15-20-17-10-12-18(13-11-17)21-16-9-7-14-19/h10-13H,2-9,14-16H2,1H3 |
| InChIKey | LFLAHHFVWNSFAS-UHFFFAOYSA-N |
| Molecular Weight | 357.332 g/mol |
| SMILES | C=1(C=CC(=CC1)OCCCCCCCC)OCCCCBr |