| SpectraBase Compound ID | 71UtTX8X99Z |
|---|---|
| InChI | InChI=1S/C13H19NO2/c1-2-3-4-11-5-7-12(8-6-11)13(16)14-9-10-15/h5-8,15H,2-4,9-10H2,1H3,(H,14,16) |
| InChIKey | XHLSZMKXBQFJLB-UHFFFAOYSA-N |
| Mol Weight | 221.3 g/mol |
| Molecular Formula | C13H19NO2 |
| Exact Mass | 221.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 74f2trwmbp2 |
|---|---|
| Name | N-(2-Hydroxyethyl)-4-butylbenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.141578854 u |
| Formula | C13H19NO2 |
| InChI | InChI=1S/C13H19NO2/c1-2-3-4-11-5-7-12(8-6-11)13(16)14-9-10-15/h5-8,15H,2-4,9-10H2,1H3,(H,14,16) |
| InChIKey | XHLSZMKXBQFJLB-UHFFFAOYSA-N |
| Molecular Weight | 221.300 g/mol |
| SMILES | C1(C(NCCO)=O)=CC=C(C=C1)CCCC |