| SpectraBase Compound ID | KB4WQdCxB0c |
|---|---|
| InChI | InChI=1S/C8H19N/c1-4-7(2)5-6-8(3)9/h7-8H,4-6,9H2,1-3H3 |
| InChIKey | IGELDTXGMACMRK-UHFFFAOYSA-N |
| Mol Weight | 129.25 g/mol |
| Molecular Formula | C8H19N |
| Exact Mass | 129.15175 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FkMEqfnziGQ |
|---|---|
| Name | 2-Heptanamine, 5-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 129.151749616 u |
| Formula | C8H19N |
| InChI | InChI=1S/C8H19N/c1-4-7(2)5-6-8(3)9/h7-8H,4-6,9H2,1-3H3 |
| InChIKey | IGELDTXGMACMRK-UHFFFAOYSA-N |
| Molecular Weight | 129.247 g/mol |
| SMILES | C(C(CC)C)CC(C)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.803861 |