| SpectraBase Compound ID | 6Rk2ECrzcqp |
|---|---|
| InChI | InChI=1S/C12H17BrO/c1-2-3-9-14-10-8-11-6-4-5-7-12(11)13/h4-7H,2-3,8-10H2,1H3 |
| InChIKey | NUTGLIZPVHREAP-UHFFFAOYSA-N |
| Mol Weight | 257.17 g/mol |
| Molecular Formula | C12H17BrO |
| Exact Mass | 256.046278 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kx5Nt8i148U |
|---|---|
| Name | 2-Bromophenethyl alcohol, N-butyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.046278166 u |
| Formula | C12H17BrO |
| InChI | InChI=1S/C12H17BrO/c1-2-3-9-14-10-8-11-6-4-5-7-12(11)13/h4-7H,2-3,8-10H2,1H3 |
| InChIKey | NUTGLIZPVHREAP-UHFFFAOYSA-N |
| Molecular Weight | 257.171 g/mol |
| SMILES | C1(=C(C=CC=C1)Br)CCOCCCC |