| SpectraBase Compound ID | 25jFHUSXNy6 |
|---|---|
| InChI | InChI=1S/C13H27NO2/c1-4-6-8-10-12-16-13(15)14(3)11-9-7-5-2/h4-12H2,1-3H3 |
| InChIKey | SOQKWRRCAQIXKW-UHFFFAOYSA-N |
| Mol Weight | 229.36 g/mol |
| Molecular Formula | C13H27NO2 |
| Exact Mass | 229.204179 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LlnVvSztkjm |
|---|---|
| Name | Carbamic acid, N-methyl-N-pentyl-, hexyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.204179111 u |
| Formula | C13H27NO2 |
| InChI | InChI=1S/C13H27NO2/c1-4-6-8-10-12-16-13(15)14(3)11-9-7-5-2/h4-12H2,1-3H3 |
| InChIKey | SOQKWRRCAQIXKW-UHFFFAOYSA-N |
| Molecular Weight | 229.364 g/mol |
| SMILES | C(CN(C(OCCCCCC)=O)C)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964503 |