![4-Pentadecanol, 3-bromo-, [S-(R*,S*)]-](/api/spectrum/7l2mW6qUSe5/structure.png?h=300&w=458 "4-Pentadecanol, 3-bromo-, [S-(R*,S*)]-")
| SpectraBase Compound ID | 9F0M5iAQ8pU |
|---|---|
| InChI | InChI=1S/C15H31BrO/c1-3-5-6-7-8-9-10-11-12-13-15(17)14(16)4-2/h14-15,17H,3-13H2,1-2H3 |
| InChIKey | XDQXYAIBSJCAES-UHFFFAOYSA-N |
| Mol Weight | 307.32 g/mol |
| Molecular Formula | C15H31BrO |
| Exact Mass | 306.155829 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7l2mW6qUSe5 |
|---|---|
| Name | 4-Pentadecanol, 3-bromo-, [S-(R*,S*)]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.155828617 u |
| Formula | C15H31BrO |
| InChI | InChI=1S/C15H31BrO/c1-3-5-6-7-8-9-10-11-12-13-15(17)14(16)4-2/h14-15,17H,3-13H2,1-2H3 |
| InChIKey | XDQXYAIBSJCAES-UHFFFAOYSA-N |
| Molecular Weight | 307.316 g/mol |
| SMILES | C(C(O)CCCCCCCCCCC)(Br)CC |