| SpectraBase Compound ID | uqYWfoc8bA |
|---|---|
| InChI | InChI=1S/C13H27NO/c1-5-7-12(8-6-2)13(15)14-10-9-11(3)4/h11-12H,5-10H2,1-4H3,(H,14,15) |
| InChIKey | ZQAJQSIROFNICU-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 | 7T5k1vTHl5n |
|---|---|
| Name | Valeramide, 2-propyl-N-(3-methylbutyl)- |
| 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/c1-5-7-12(8-6-2)13(15)14-10-9-11(3)4/h11-12H,5-10H2,1-4H3,(H,14,15) |
| InChIKey | ZQAJQSIROFNICU-UHFFFAOYSA-N |
| Molecular Weight | 213.365 g/mol |
| SMILES | CCCC(C(NCCC(C)C)=O)CCC |