| SpectraBase Compound ID | 53KLXXUPW7H |
|---|---|
| InChI | InChI=1S/C13H27NO/c1-4-6-7-8-9-11-14-13(15)12(3)10-5-2/h12H,4-11H2,1-3H3,(H,14,15) |
| InChIKey | UVFWJYQGDKIFCL-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 | 29mA5oHpvle |
|---|---|
| Name | Valeramide, 2-methyl-N-heptyl- |
| 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/c1-4-6-7-8-9-11-14-13(15)12(3)10-5-2/h12H,4-11H2,1-3H3,(H,14,15) |
| InChIKey | UVFWJYQGDKIFCL-UHFFFAOYSA-N |
| Molecular Weight | 213.365 g/mol |
| SMILES | C(=O)(NCCCCCCC)C(CCC)C |