| SpectraBase Compound ID | 8icgPMAIKtJ |
|---|---|
| InChI | InChI=1S/C12H23NO/c1-6-8-11(5)13(7-2)12(14)9-10(3)4/h9,11H,6-8H2,1-5H3 |
| InChIKey | MZAWKODNDCETME-UHFFFAOYSA-N |
| Mol Weight | 197.32 g/mol |
| Molecular Formula | C12H23NO |
| Exact Mass | 197.177964 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AO1rTP8srNl |
|---|---|
| Name | but-2-Enoylamide, 3-methyl-N-(2-pentyl)-N-ethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.177964364 u |
| Formula | C12H23NO |
| InChI | InChI=1S/C12H23NO/c1-6-8-11(5)13(7-2)12(14)9-10(3)4/h9,11H,6-8H2,1-5H3 |
| InChIKey | MZAWKODNDCETME-UHFFFAOYSA-N |
| Molecular Weight | 197.322 g/mol |
| SMILES | C(N(C(CCC)C)C(=O)C=C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965477 |