| SpectraBase Compound ID | 94UXuaz0bvg |
|---|---|
| InChI | InChI=1S/C8H11BrO/c1-7-4-5-8(10-7)3-2-6-9/h4-5H,2-3,6H2,1H3 |
| InChIKey | LTAHFFQVBBMRHQ-UHFFFAOYSA-N |
| Mol Weight | 203.08 g/mol |
| Molecular Formula | C8H11BrO |
| Exact Mass | 201.999328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ZVwDsoFuKj |
|---|---|
| Name | 2-(3-Bromopropyl)-5-methylfuran |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.999327973 u |
| Formula | C8H11BrO |
| InChI | InChI=1S/C8H11BrO/c1-7-4-5-8(10-7)3-2-6-9/h4-5H,2-3,6H2,1H3 |
| InChIKey | LTAHFFQVBBMRHQ-UHFFFAOYSA-N |
| Molecular Weight | 203.079 g/mol |
| SMILES | C=1(OC(=CC1)C)CCCBr |