| SpectraBase Compound ID | 2sYR38qAETc |
|---|---|
| InChI | InChI=1S/C14H31N/c1-5-7-9-11-15(13-14(3)4)12-10-8-6-2/h14H,5-13H2,1-4H3 |
| InChIKey | CUJCOUCVNXQKSP-UHFFFAOYSA-N |
| Mol Weight | 213.41 g/mol |
| Molecular Formula | C14H31N |
| Exact Mass | 213.24565 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ESHkXu1V14T |
|---|---|
| Name | Isobutylamine, N,N-dipentyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.245650002 u |
| Formula | C14H31N |
| InChI | InChI=1S/C14H31N/c1-5-7-9-11-15(13-14(3)4)12-10-8-6-2/h14H,5-13H2,1-4H3 |
| InChIKey | CUJCOUCVNXQKSP-UHFFFAOYSA-N |
| Molecular Weight | 213.409 g/mol |
| SMILES | C(CCCN(CCCCC)CC(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.927424 |