| SpectraBase Compound ID | CMKp8BbjHCy |
|---|---|
| InChI | InChI=1S/C13H17NO2/c1-14(2)12-8-6-11(7-9-12)13(16)5-3-4-10-15/h3-4,6-10,13,16H,5H2,1-2H3/b4-3+ |
| InChIKey | YYDHZVADLJRUQU-ONEGZZNKSA-N |
| Mol Weight | 219.28 g/mol |
| Molecular Formula | C13H17NO2 |
| Exact Mass | 219.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AlptvScjVs |
|---|---|
| Name | 5-(Hydroxy)-5-(4-dimethylaminophenyl)pent-2-en-1-al |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 219.125928789 u |
| Formula | C13H17NO2 |
| InChI | InChI=1S/C13H17NO2/c1-14(2)12-8-6-11(7-9-12)13(16)5-3-4-10-15/h3-4,6-10,13,16H,5H2,1-2H3/b4-3+ |
| InChIKey | YYDHZVADLJRUQU-ONEGZZNKSA-N |
| Molecular Weight | 219.284 g/mol |
| SMILES | C1(N(C)C)=CC=C(C=C1)C(O)C\C=C\C=O |