| SpectraBase Compound ID | Kg11JHBOoF3 |
|---|---|
| InChI | InChI=1S/C5H11NO/c1-3-4-5-6-7-2/h5H,3-4H2,1-2H3/b6-5+ |
| InChIKey | BMDFNHAUSSAITP-AATRIKPKSA-N |
| Mol Weight | 101.15 g/mol |
| Molecular Formula | C5H11NO |
| Exact Mass | 101.084064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DDwVJnKvr8f |
|---|---|
| Name | Butanal, o-methyloxime |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 101.084063977 u |
| Formula | C5H11NO |
| InChI | InChI=1S/C5H11NO/c1-3-4-5-6-7-2/h5H,3-4H2,1-2H3/b6-5+ |
| InChIKey | BMDFNHAUSSAITP-AATRIKPKSA-N |
| Molecular Weight | 101.149 g/mol |
| SMILES | C(\C=N\OC)CC |