| SpectraBase Compound ID | KQUwzELW6Un |
|---|---|
| InChI | InChI=1S/C11H15NO/c1-7-5-9(3)11(6-8(7)2)12-10(4)13/h5-6H,1-4H3,(H,12,13) |
| InChIKey | SWNMYEWTIFFJIV-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 | L8bbhnI4K5c |
|---|---|
| Name | 2,4,5-Trimethylaniline, N-acetyl- |
| 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/c1-7-5-9(3)11(6-8(7)2)12-10(4)13/h5-6H,1-4H3,(H,12,13) |
| InChIKey | SWNMYEWTIFFJIV-UHFFFAOYSA-N |
| Molecular Weight | 177.247 g/mol |
| SMILES | C1(NC(C)=O)=C(C=C(C(=C1)C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.935225 |