| SpectraBase Compound ID | 452u45vF3CM |
|---|---|
| InChI | InChI=1S/C11H15NO/c1-11(2,3)10(13)8-6-4-5-7-9(8)12/h4-7H,12H2,1-3H3 |
| InChIKey | MOUSJBUJZMBYLN-UHFFFAOYSA-N |
| Mol Weight | 177.25 g/mol |
| Molecular Formula | C11H15NO |
| Exact Mass | 177.115364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 73Xl2FHIQtK |
|---|---|
| Name | 1-Propanone, 1-(2-aminophenyl)-2,2-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.115364106 u |
| Formula | C11H15NO |
| InChI | InChI=1S/C11H15NO/c1-11(2,3)10(13)8-6-4-5-7-9(8)12/h4-7H,12H2,1-3H3 |
| InChIKey | MOUSJBUJZMBYLN-UHFFFAOYSA-N |
| Molecular Weight | 177.247 g/mol |
| SMILES | C1=CC=C(C(=C1)C(C(C)(C)C)=O)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.860923 |