| SpectraBase Compound ID | 63q8YTQcYFx |
|---|---|
| InChI | InChI=1S/C11H17N/c1-3-11(2,9-12)10-7-5-4-6-8-10/h4-8H,3,9,12H2,1-2H3/t11-/m1/s1 |
| InChIKey | AIJJJDSZSFVICV-LLVKDONJSA-N |
| Mol Weight | 163.26 g/mol |
| Molecular Formula | C11H17N |
| Exact Mass | 163.1361 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CMy8BXIyZ0y |
|---|---|
| Name | (2S)-2-Methyl-2-phenyl-1-butanamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 163.136099551 u |
| Formula | C11H17N |
| InChI | InChI=1S/C11H17N/c1-3-11(2,9-12)10-7-5-4-6-8-10/h4-8H,3,9,12H2,1-2H3/t11-/m1/s1 |
| InChIKey | AIJJJDSZSFVICV-LLVKDONJSA-N |
| Molecular Weight | 163.264 g/mol |
| SMILES | [C@@](C1=CC=CC=C1)(CN)(CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.909551 |