| SpectraBase Compound ID | LgMCyfXely2 |
|---|---|
| InChI | InChI=1S/C17H36N2O/c1-3-5-7-9-11-13-15-18-17(20)19-16-14-12-10-8-6-4-2/h3-16H2,1-2H3,(H2,18,19,20) |
| InChIKey | NLCAUVFHXKUYMZ-UHFFFAOYSA-N |
| Mol Weight | 284.5 g/mol |
| Molecular Formula | C17H36N2O |
| Exact Mass | 284.282764 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9OzpDDCGyyX |
|---|---|
| Name | N,N'-Dioctylurea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.282763786 u |
| Formula | C17H36N2O |
| InChI | InChI=1S/C17H36N2O/c1-3-5-7-9-11-13-15-18-17(20)19-16-14-12-10-8-6-4-2/h3-16H2,1-2H3,(H2,18,19,20) |
| InChIKey | NLCAUVFHXKUYMZ-UHFFFAOYSA-N |
| SMILES | C(NCCCCCCCC)(=O)NCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.807784 |