| SpectraBase Compound ID | ASxv8GrcgLu |
|---|---|
| InChI | InChI=1S/C12H19N/c1-4-10(2)13-11(3)12-8-6-5-7-9-12/h5-11,13H,4H2,1-3H3/t10-,11-/m0/s1 |
| InChIKey | PXWVXIBJJNDWLW-QWRGUYRKSA-N |
| Mol Weight | 177.29 g/mol |
| Molecular Formula | C12H19N |
| Exact Mass | 177.15175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9oUBB5VjhgD |
|---|---|
| Name | (2S)-N-((S)-1-Phenylethyl)butan-2-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.151749616 u |
| Formula | C12H19N |
| InChI | InChI=1S/C12H19N/c1-4-10(2)13-11(3)12-8-6-5-7-9-12/h5-11,13H,4H2,1-3H3/t10-,11-/m0/s1 |
| InChIKey | PXWVXIBJJNDWLW-QWRGUYRKSA-N |
| Molecular Weight | 177.291 g/mol |
| SMILES | C([C@](C)(N[C@@](C)(C=1C=CC=CC1)[H])[H])C |