| SpectraBase Compound ID | GOnEZjYfSZa |
|---|---|
| InChI | InChI=1S/C14H21NO2/c1-5-14(16)15-11(3)9-12-6-7-13(17-4)10(2)8-12/h6-8,11H,5,9H2,1-4H3,(H,15,16) |
| InChIKey | NRWLVODWRZZUAO-UHFFFAOYSA-N |
| Mol Weight | 235.33 g/mol |
| Molecular Formula | C14H21NO2 |
| Exact Mass | 235.157229 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9b15XTEEXXJ |
|---|---|
| Name | 3-me-4-ma Prop |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.157228918 u |
| Formula | C14H21NO2 |
| InChI | InChI=1S/C14H21NO2/c1-5-14(16)15-11(3)9-12-6-7-13(17-4)10(2)8-12/h6-8,11H,5,9H2,1-4H3,(H,15,16) |
| InChIKey | NRWLVODWRZZUAO-UHFFFAOYSA-N |
| Molecular Weight | 235.327 g/mol |
| SMILES | C(NC(CC)=O)(CC1=CC(=C(C=C1)OC)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.970723 |