| SpectraBase Compound ID | Ac7JHCCDV0K |
|---|---|
| InChI | InChI=1S/C18H31N/c1-3-4-5-6-7-8-12-15-19-17(2)16-18-13-10-9-11-14-18/h9-11,13-14,17,19H,3-8,12,15-16H2,1-2H3 |
| InChIKey | YGWMAVXTRKBDHE-UHFFFAOYSA-N |
| Mol Weight | 261.45 g/mol |
| Molecular Formula | C18H31N |
| Exact Mass | 261.24565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | keDbgmz7eM |
|---|---|
| Name | N-Nonyl-amphetamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.245650002 u |
| Formula | C18H31N |
| InChI | InChI=1S/C18H31N/c1-3-4-5-6-7-8-12-15-19-17(2)16-18-13-10-9-11-14-18/h9-11,13-14,17,19H,3-8,12,15-16H2,1-2H3 |
| InChIKey | YGWMAVXTRKBDHE-UHFFFAOYSA-N |
| Molecular Weight | 261.453 g/mol |
| SMILES | C1(CC(NCCCCCCCCC)C)=CC=CC=C1 |