| SpectraBase Compound ID | 28lArwAiObT |
|---|---|
| InChI | InChI=1S/C13H27NO/c1-7-8-12(6)14(9-10(2)3)13(15)11(4)5/h10-12H,7-9H2,1-6H3 |
| InChIKey | NUYIWLKYZPPHPJ-UHFFFAOYSA-N |
| Mol Weight | 213.36 g/mol |
| Molecular Formula | C13H27NO |
| Exact Mass | 213.209264 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5QmOZ17kftp |
|---|---|
| Name | Isobutyramide, N-(2-pentyl)-N-isobutyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.209264492 u |
| Formula | C13H27NO |
| InChI | InChI=1S/C13H27NO/c1-7-8-12(6)14(9-10(2)3)13(15)11(4)5/h10-12H,7-9H2,1-6H3 |
| InChIKey | NUYIWLKYZPPHPJ-UHFFFAOYSA-N |
| Molecular Weight | 213.365 g/mol |
| SMILES | C(N(C(CCC)C)C(=O)C(C)C)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.933123 |