| SpectraBase Compound ID | Q0cfcoLLRu |
|---|---|
| InChI | InChI=1S/C12H25NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2-12H2,1H3 |
| InChIKey | MQEMKUTWMALMCC-UHFFFAOYSA-N |
| Mol Weight | 215.34 g/mol |
| Molecular Formula | C12H25NO2 |
| Exact Mass | 215.188529 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IfegMArwlfw |
|---|---|
| Name | 1-Nitrododecane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.188529047 u |
| Formula | C12H25NO2 |
| InChI | InChI=1S/C12H25NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2-12H2,1H3 |
| InChIKey | MQEMKUTWMALMCC-UHFFFAOYSA-N |
| Molecular Weight | 215.337 g/mol |
| SMILES | CCCCCCCCCCCCN(=O)=O |