| SpectraBase Compound ID | F33StuTijbE |
|---|---|
| InChI | InChI=1S/C7H15NO/c1-4-5-8-7(9)6(2)3/h6H,4-5H2,1-3H3,(H,8,9) |
| InChIKey | FYRBHLFWWSLQGB-UHFFFAOYSA-N |
| Mol Weight | 129.2 g/mol |
| Molecular Formula | C7H15NO |
| Exact Mass | 129.115364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DNBcdxPgeuv |
|---|---|
| Name | Isobutyramide, N-propyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 129.115364106 u |
| Formula | C7H15NO |
| InChI | InChI=1S/C7H15NO/c1-4-5-8-7(9)6(2)3/h6H,4-5H2,1-3H3,(H,8,9) |
| InChIKey | FYRBHLFWWSLQGB-UHFFFAOYSA-N |
| Molecular Weight | 129.203 g/mol |
| SMILES | C(C(=O)NCCC)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97924 |