| SpectraBase Compound ID | 1JEQX1M7fWo |
|---|---|
| InChI | InChI=1S/C11H17NO/c1-9(10(2)13)12(3)11-7-5-4-6-8-11/h4-10,13H,1-3H3 |
| InChIKey | KMXRLARVGQBCAE-UHFFFAOYSA-N |
| Mol Weight | 179.26 g/mol |
| Molecular Formula | C11H17NO |
| Exact Mass | 179.131014 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 72PXGRNMcx0 |
|---|---|
| Name | 3-(Methyl-phenyl-amino)-butan-2-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 179.131014170 u |
| Formula | C11H17NO |
| InChI | InChI=1S/C11H17NO/c1-9(10(2)13)12(3)11-7-5-4-6-8-11/h4-10,13H,1-3H3 |
| InChIKey | KMXRLARVGQBCAE-UHFFFAOYSA-N |
| Molecular Weight | 179.263 g/mol |
| SMILES | C(N(C1=CC=CC=C1)C)(C(O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.831284 |