| SpectraBase Compound ID | FSOPyj2Ldu9 |
|---|---|
| InChI | InChI=1S/C13H19BrO/c1-2-3-6-10-15-11-9-12-7-4-5-8-13(12)14/h4-5,7-8H,2-3,6,9-11H2,1H3 |
| InChIKey | KRYMSYGAIWWVMY-UHFFFAOYSA-N |
| Mol Weight | 271.2 g/mol |
| Molecular Formula | C13H19BrO |
| Exact Mass | 270.061928 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 45tXUBGYhpB |
|---|---|
| Name | 2-Bromophenethyl alcohol, N-pentyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.061928231 u |
| Formula | C13H19BrO |
| InChI | InChI=1S/C13H19BrO/c1-2-3-6-10-15-11-9-12-7-4-5-8-13(12)14/h4-5,7-8H,2-3,6,9-11H2,1H3 |
| InChIKey | KRYMSYGAIWWVMY-UHFFFAOYSA-N |
| SMILES | C1(=C(C=CC=C1)Br)CCOCCCCC |