| SpectraBase Compound ID | DuEf4MNmsmS |
|---|---|
| InChI | InChI=1S/C6H13NO/c1-6(2)3-4-7-5-8/h5-6H,3-4H2,1-2H3,(H,7,8) |
| InChIKey | WRWGCPXFAJKWDW-UHFFFAOYSA-N |
| Mol Weight | 115.18 g/mol |
| Molecular Formula | C6H13NO |
| Exact Mass | 115.099714 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | A0T9X8Kt3vE |
|---|---|
| Name | N-Isopentylformamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 115.099714042 u |
| Formula | C6H13NO |
| InChI | InChI=1S/C6H13NO/c1-6(2)3-4-7-5-8/h5-6H,3-4H2,1-2H3,(H,7,8) |
| InChIKey | WRWGCPXFAJKWDW-UHFFFAOYSA-N |
| Molecular Weight | 115.176 g/mol |
| SMILES | C(NCCC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.840352 |