| SpectraBase Compound ID | LoA49EmuBQp |
|---|---|
| InChI | InChI=1S/C13H27NO/c1-5-8-9-10-13(15)14(11-6-2)12(4)7-3/h12H,5-11H2,1-4H3 |
| InChIKey | VTWMUENIKNRZFN-UHFFFAOYSA-N |
| Mol Weight | 213.36 g/mol |
| Molecular Formula | C13H27NO |
| Exact Mass | 213.209264 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Uv826UBLow |
|---|---|
| Name | Hexanamide, N-(2-butyl)-N-propyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.209264492 u |
| Formula | C13H27NO |
| InChI | InChI=1S/C13H27NO/c1-5-8-9-10-13(15)14(11-6-2)12(4)7-3/h12H,5-11H2,1-4H3 |
| InChIKey | VTWMUENIKNRZFN-UHFFFAOYSA-N |
| Molecular Weight | 213.365 g/mol |
| SMILES | C(=O)(N(CCC)C(CC)C)CCCCC |