| SpectraBase Compound ID | KGS9okvXTAD |
|---|---|
| InChI | InChI=1S/C9H11NO/c1-3-5-7-9(11)10-8-6-4-2/h1-2H,5-8H2,(H,10,11) |
| InChIKey | JVIITLYHFCSROD-UHFFFAOYSA-N |
| Mol Weight | 149.19 g/mol |
| Molecular Formula | C9H11NO |
| Exact Mass | 149.084064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9r3MpeEKrVw |
|---|---|
| Name | N-but-3-Ynyl-4-pentynamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 149.084063977 u |
| Formula | C9H11NO |
| InChI | InChI=1S/C9H11NO/c1-3-5-7-9(11)10-8-6-4-2/h1-2H,5-8H2,(H,10,11) |
| InChIKey | JVIITLYHFCSROD-UHFFFAOYSA-N |
| Molecular Weight | 149.193 g/mol |
| SMILES | C(#C)CCC(=O)NCCC#C |