| SpectraBase Compound ID | D4U2AhNS1XU |
|---|---|
| InChI | InChI=1S/C13H25NO/c1-5-7-8-12(6-2)10-14-13(15)9-11(3)4/h9,12H,5-8,10H2,1-4H3,(H,14,15) |
| InChIKey | GVFGWDRUEKBYLY-UHFFFAOYSA-N |
| Mol Weight | 211.35 g/mol |
| Molecular Formula | C13H25NO |
| Exact Mass | 211.193614 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JbW4Qhp4so7 |
|---|---|
| Name | but-2-Enoylamide, 3-methyl-N-2-ethylhexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.193614428 u |
| Formula | C13H25NO |
| InChI | InChI=1S/C13H25NO/c1-5-7-8-12(6-2)10-14-13(15)9-11(3)4/h9,12H,5-8,10H2,1-4H3,(H,14,15) |
| InChIKey | GVFGWDRUEKBYLY-UHFFFAOYSA-N |
| Molecular Weight | 211.349 g/mol |
| SMILES | C(C=C(C)C)(NCC(CCCC)CC)=O |