![(3S)-N-[(S)-1-Phenylethyl]nonan-3-amine](/api/spectrum/EhdFq5lvPk2/structure.png?h=300&w=458 "(3S)-N-[(S)-1-Phenylethyl]nonan-3-amine")
| SpectraBase Compound ID | zbfOgU2K8c |
|---|---|
| InChI | InChI=1S/C17H29N/c1-4-6-7-11-14-17(5-2)18-15(3)16-12-9-8-10-13-16/h8-10,12-13,15,17-18H,4-7,11,14H2,1-3H3/t15-,17-/m0/s1 |
| InChIKey | ALHFCKMACDZFTF-RDJZCZTQSA-N |
| Mol Weight | 247.43 g/mol |
| Molecular Formula | C17H29N |
| Exact Mass | 247.23 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EhdFq5lvPk2 |
|---|---|
| Name | (3S)-N-[(S)-1-Phenylethyl]nonan-3-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.229999938 u |
| Formula | C17H29N |
| InChI | InChI=1S/C17H29N/c1-4-6-7-11-14-17(5-2)18-15(3)16-12-9-8-10-13-16/h8-10,12-13,15,17-18H,4-7,11,14H2,1-3H3/t15-,17-/m0/s1 |
| InChIKey | ALHFCKMACDZFTF-RDJZCZTQSA-N |
| Molecular Weight | 247.426 g/mol |
| SMILES | [C@](N[C@@](CC)(CCCCCC)[H])(C1=CC=CC=C1)(C)[H] |