| SpectraBase Compound ID | Bl3K0w8rSFP |
|---|---|
| InChI | InChI=1S/C9H19NO/c1-4-5-9(11)10-7-6-8(2)3/h8H,4-7H2,1-3H3,(H,10,11) |
| InChIKey | ZMVUBAWVKPMTRT-UHFFFAOYSA-N |
| Mol Weight | 157.26 g/mol |
| Molecular Formula | C9H19NO |
| Exact Mass | 157.146664 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CiBYjPCBefU |
|---|---|
| Name | N-Isopentylbutyramide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 157.146664235 u |
| Formula | C9H19NO |
| InChI | InChI=1S/C9H19NO/c1-4-5-9(11)10-7-6-8(2)3/h8H,4-7H2,1-3H3,(H,10,11) |
| InChIKey | ZMVUBAWVKPMTRT-UHFFFAOYSA-N |
| Molecular Weight | 157.257 g/mol |
| SMILES | C(NCCC(C)C)(CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9803 |