| SpectraBase Compound ID | 8ygIf5uq8DG |
|---|---|
| InChI | InChI=1S/C7H17N/c1-3-5-7(8)6-4-2/h7H,3-6,8H2,1-2H3 |
| InChIKey | CLJMMQGDJNYDER-UHFFFAOYSA-N |
| Mol Weight | 115.22 g/mol |
| Molecular Formula | C7H17N |
| Exact Mass | 115.1361 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 2gUz3clPyol |
|---|---|
| Name | 1-Propylbutylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 115.136099551 u |
| Formula | C7H17N |
| InChI | InChI=1S/C7H17N/c1-3-5-7(8)6-4-2/h7H,3-6,8H2,1-2H3 |
| InChIKey | CLJMMQGDJNYDER-UHFFFAOYSA-N |
| Molecular Weight | 115.220 g/mol |
| SMILES | NC(CCC)CCC |
| Spectrum/Structure Validation Score (Raman) | 0.934792 |