| SpectraBase Compound ID | 6ZFTyJ1MVuY |
|---|---|
| InChI | InChI=1S/C19H31NO/c1-4-6-11-20(12-7-5-2)16(3)14-17-8-9-19-18(15-17)10-13-21-19/h8-9,15-16H,4-7,10-14H2,1-3H3 |
| InChIKey | MGKGZJONTATIBU-UHFFFAOYSA-N |
| Mol Weight | 289.46 g/mol |
| Molecular Formula | C19H31NO |
| Exact Mass | 289.240565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EE73wESqYbH |
|---|---|
| Name | 5-Apdb 2bu |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.240564621 u |
| Formula | C19H31NO |
| InChI | InChI=1S/C19H31NO/c1-4-6-11-20(12-7-5-2)16(3)14-17-8-9-19-18(15-17)10-13-21-19/h8-9,15-16H,4-7,10-14H2,1-3H3 |
| InChIKey | MGKGZJONTATIBU-UHFFFAOYSA-N |
| Molecular Weight | 289.463 g/mol |
| SMILES | C1=2C(=CC(CC(N(CCCC)CCCC)C)=CC2)CCO1 |