| SpectraBase Compound ID | Cnj7B5QTVsB |
|---|---|
| InChI | InChI=1S/C14H21NO2/c1-14(2,3)12(16)9-10-15-13(17)11-7-5-4-6-8-11/h4-8,12,16H,9-10H2,1-3H3,(H,15,17) |
| InChIKey | IMBBEWBQYDWSQW-UHFFFAOYSA-N |
| Mol Weight | 235.33 g/mol |
| Molecular Formula | C14H21NO2 |
| Exact Mass | 235.157229 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3gizTsKCcZV |
|---|---|
| Name | N-(3-Hydroxy-4,4-dimethylpentyl)benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.157228918 u |
| Formula | C14H21NO2 |
| InChI | InChI=1S/C14H21NO2/c1-14(2,3)12(16)9-10-15-13(17)11-7-5-4-6-8-11/h4-8,12,16H,9-10H2,1-3H3,(H,15,17) |
| InChIKey | IMBBEWBQYDWSQW-UHFFFAOYSA-N |
| Molecular Weight | 235.327 g/mol |
| SMILES | C(C=1C=CC=CC1)(=O)NCCC(C(C)(C)C)O |