| SpectraBase Compound ID | CizSuoEBVEL |
|---|---|
| InChI | InChI=1S/C14H29N/c1-3-8-14(9-4-2)15-12-13-10-6-5-7-11-13/h13-15H,3-12H2,1-2H3 |
| InChIKey | IKVDDYXQPRDTNW-UHFFFAOYSA-N |
| Mol Weight | 211.39 g/mol |
| Molecular Formula | C14H29N |
| Exact Mass | 211.23 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5ltKPBQbDQb |
|---|---|
| Name | Butanamine, N-cyclohexylmethyl-1-propyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.229999938 u |
| Formula | C14H29N |
| InChI | InChI=1S/C14H29N/c1-3-8-14(9-4-2)15-12-13-10-6-5-7-11-13/h13-15H,3-12H2,1-2H3 |
| InChIKey | IKVDDYXQPRDTNW-UHFFFAOYSA-N |
| Molecular Weight | 211.393 g/mol |
| SMILES | C1CCC(CNC(CCC)CCC)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.942446 |