| SpectraBase Compound ID | IKsbssg7qq0 |
|---|---|
| InChI | InChI=1S/C6H13NO/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3,(H2,7,8) |
| InChIKey | ACMPWZQOUILVFB-UHFFFAOYSA-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 | 9YLCALUTfKJ |
|---|---|
| Name | Pentanamide, 4-methyl- |
| 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/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3,(H2,7,8) |
| InChIKey | ACMPWZQOUILVFB-UHFFFAOYSA-N |
| Molecular Weight | 115.176 g/mol |
| SMILES | CC(CCC(=O)N)C |