![N-[(1S)-1-(hydroxymethyl)pentyl]acetamide](/api/spectrum/655Thk3k1vb/structure.png?h=300&w=458 "N-[(1S)-1-(hydroxymethyl)pentyl]acetamide")
| SpectraBase Compound ID | LlBYEskv4t1 |
|---|---|
| InChI | InChI=1S/C8H17NO2/c1-3-4-5-8(6-10)9-7(2)11/h8,10H,3-6H2,1-2H3,(H,9,11)/t8-/m0/s1 |
| InChIKey | YDBNDBFRLUSTLP-QMMMGPOBSA-N |
| Mol Weight | 159.23 g/mol |
| Molecular Formula | C8H17NO2 |
| Exact Mass | 159.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 655Thk3k1vb |
|---|---|
| Name | N-[(1S)-1-(Hydroxymethyl)pentyl]acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 159.125928789 u |
| Formula | C8H17NO2 |
| InChI | InChI=1S/C8H17NO2/c1-3-4-5-8(6-10)9-7(2)11/h8,10H,3-6H2,1-2H3,(H,9,11)/t8-/m0/s1 |
| InChIKey | YDBNDBFRLUSTLP-QMMMGPOBSA-N |
| Molecular Weight | 159.229 g/mol |
| SMILES | C(N[C@](CO)(CCCC)[H])(=O)C |