| SpectraBase Compound ID | 1fVkMmr2JLz |
|---|---|
| InChI | InChI=1S/C6H13NO/c1-4-5-6(2)7-8-3/h4-5H2,1-3H3/b7-6+ |
| InChIKey | CMUPRWBXGFPVTG-VOTSOKGWSA-N |
| Mol Weight | 115.18 g/mol |
| Molecular Formula | C6H13NO |
| Exact Mass | 115.099714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FnE7oI0cpJQ |
|---|---|
| Name | 2-Pentanone, o-methyloxime |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 115.099714042 u |
| Formula | C6H13NO |
| InChI | InChI=1S/C6H13NO/c1-4-5-6(2)7-8-3/h4-5H2,1-3H3/b7-6+ |
| InChIKey | CMUPRWBXGFPVTG-VOTSOKGWSA-N |
| Molecular Weight | 115.176 g/mol |
| SMILES | C(\C(=N\OC)C)CC |