![Phenol, 4-cyclohexyl-o-[4-bromo-N-butyl]-](/api/spectrum/HYaqWusLVEe/structure.png?h=300&w=458 "Phenol, 4-cyclohexyl-o-[4-bromo-N-butyl]-")
| SpectraBase Compound ID | JTELJYlwidL |
|---|---|
| InChI | InChI=1S/C16H23BrO/c17-12-4-5-13-18-16-10-8-15(9-11-16)14-6-2-1-3-7-14/h8-11,14H,1-7,12-13H2 |
| InChIKey | MWSHYGRPFMBGFS-UHFFFAOYSA-N |
| Mol Weight | 311.26 g/mol |
| Molecular Formula | C16H23BrO |
| Exact Mass | 310.093228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HYaqWusLVEe |
|---|---|
| Name | Phenol, 4-cyclohexyl-o-[4-bromo-N-butyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.093228360 u |
| Formula | C16H23BrO |
| InChI | InChI=1S/C16H23BrO/c17-12-4-5-13-18-16-10-8-15(9-11-16)14-6-2-1-3-7-14/h8-11,14H,1-7,12-13H2 |
| InChIKey | MWSHYGRPFMBGFS-UHFFFAOYSA-N |
| Molecular Weight | 311.263 g/mol |
| SMILES | C1CCC(CC1)C1=CC=C(C=C1)OCCCCBr |