![Phenol, 4-[3-(1-perhydroazocinyl)butyl]-](/api/spectrum/Fm7RT7KkMo2/structure.png?h=300&w=458 "Phenol, 4-[3-(1-perhydroazocinyl)butyl]-")
| SpectraBase Compound ID | 8jOEgCcOhT3 |
|---|---|
| InChI | InChI=1S/C17H27NO/c1-15(18-13-5-3-2-4-6-14-18)7-8-16-9-11-17(19)12-10-16/h9-12,15,19H,2-8,13-14H2,1H3 |
| InChIKey | DQGHXBYRUIRJGZ-UHFFFAOYSA-N |
| Mol Weight | 261.41 g/mol |
| Molecular Formula | C17H27NO |
| Exact Mass | 261.209264 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fm7RT7KkMo2 |
|---|---|
| Name | Phenol, 4-[3-(1-perhydroazocinyl)butyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.209264492 u |
| Formula | C17H27NO |
| InChI | InChI=1S/C17H27NO/c1-15(18-13-5-3-2-4-6-14-18)7-8-16-9-11-17(19)12-10-16/h9-12,15,19H,2-8,13-14H2,1H3 |
| InChIKey | DQGHXBYRUIRJGZ-UHFFFAOYSA-N |
| Molecular Weight | 261.409 g/mol |
| SMILES | C1CN(CCCCC1)C(CCC=1C=CC(=CC1)O)C |