| SpectraBase Compound ID | 1YHdeHvKr6d |
|---|---|
| InChI | InChI=1S/C10H13NO/c1-8(2)6-10(12)9-4-3-5-11-7-9/h3-5,7-8H,6H2,1-2H3 |
| InChIKey | UYDDFOUEMHGSEZ-UHFFFAOYSA-N |
| Mol Weight | 163.22 g/mol |
| Molecular Formula | C10H13NO |
| Exact Mass | 163.099714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Iq9l1l7dRbs |
|---|---|
| Name | 1-Butanone, 3-methyl-1-(3-pyridinyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 163.099714042 u |
| Formula | C10H13NO |
| InChI | InChI=1S/C10H13NO/c1-8(2)6-10(12)9-4-3-5-11-7-9/h3-5,7-8H,6H2,1-2H3 |
| InChIKey | UYDDFOUEMHGSEZ-UHFFFAOYSA-N |
| Molecular Weight | 163.220 g/mol |
| SMILES | C1(=CN=CC=C1)C(CC(C)C)=O |