| SpectraBase Compound ID | 4QdG44oQePj |
|---|---|
| InChI | InChI=1S/C14H21NO3/c1-10(15-12(3)17)8-13-4-6-14(7-5-13)18-9-11(2)16/h4-7,10-11,16H,8-9H2,1-3H3,(H,15,17) |
| InChIKey | PAUPKPOWPGCSII-UHFFFAOYSA-N |
| Mol Weight | 251.33 g/mol |
| Molecular Formula | C14H21NO3 |
| Exact Mass | 251.152144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5amy4RHqjIM |
|---|---|
| Name | N-Acetyl-4-(2-hydroxypropoxy)amphetamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.152143537 u |
| Formula | C14H21NO3 |
| InChI | InChI=1S/C14H21NO3/c1-10(15-12(3)17)8-13-4-6-14(7-5-13)18-9-11(2)16/h4-7,10-11,16H,8-9H2,1-3H3,(H,15,17) |
| InChIKey | PAUPKPOWPGCSII-UHFFFAOYSA-N |
| Molecular Weight | 251.326 g/mol |
| SMILES | C1=CC(=CC=C1OCC(C)O)CC(NC(C)=O)C |