| SpectraBase Compound ID | DOIPDASrM20 |
|---|---|
| InChI | InChI=1S/C10H21NO/c1-6-9(5)11(7-2)10(12)8(3)4/h8-9H,6-7H2,1-5H3 |
| InChIKey | ZDQLHFDMWRJGDX-UHFFFAOYSA-N |
| Mol Weight | 171.28 g/mol |
| Molecular Formula | C10H21NO |
| Exact Mass | 171.162314 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4Ym5uzzL88s |
|---|---|
| Name | Isobutyramide, N-(2-butyl)-N-ethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.162314299 u |
| Formula | C10H21NO |
| InChI | InChI=1S/C10H21NO/c1-6-9(5)11(7-2)10(12)8(3)4/h8-9H,6-7H2,1-5H3 |
| InChIKey | ZDQLHFDMWRJGDX-UHFFFAOYSA-N |
| Molecular Weight | 171.284 g/mol |
| SMILES | C(=O)(N(CC)C(CC)C)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.950856 |