| SpectraBase Compound ID | 6OWMyeOeFv7 |
|---|---|
| InChI | InChI=1S/C9H13BrO/c1-8-5-6-9(11-8)4-2-3-7-10/h5-6H,2-4,7H2,1H3 |
| InChIKey | QHERYWKWHFRTRI-UHFFFAOYSA-N |
| Mol Weight | 217.11 g/mol |
| Molecular Formula | C9H13BrO |
| Exact Mass | 216.014978 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5R8PeSJ7exl |
|---|---|
| Name | Furan, 2-(4-bromobutyl)-5-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.014978038 u |
| Formula | C9H13BrO |
| InChI | InChI=1S/C9H13BrO/c1-8-5-6-9(11-8)4-2-3-7-10/h5-6H,2-4,7H2,1H3 |
| InChIKey | QHERYWKWHFRTRI-UHFFFAOYSA-N |
| Molecular Weight | 217.106 g/mol |
| SMILES | C=1(OC(=CC1)C)CCCCBr |