| SpectraBase Compound ID | EoJV8HiJFgY |
|---|---|
| InChI | InChI=1S/C12H17NO/c1-13(9-5-6-10-14)11-12-7-3-2-4-8-12/h2-8,14H,9-11H2,1H3/b6-5- |
| InChIKey | POROOHUJSFGPBM-WAYWQWQTSA-N |
| Mol Weight | 191.27 g/mol |
| Molecular Formula | C12H17NO |
| Exact Mass | 191.131014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E15A2fRnUaZ |
|---|---|
| Name | 4-(N-Benzyl-N-methylamino)but-2-en-4-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 191.131014170 u |
| Formula | C12H17NO |
| InChI | InChI=1S/C12H17NO/c1-13(9-5-6-10-14)11-12-7-3-2-4-8-12/h2-8,14H,9-11H2,1H3/b6-5- |
| InChIKey | POROOHUJSFGPBM-WAYWQWQTSA-N |
| Molecular Weight | 191.274 g/mol |
| SMILES | C(\C=C/CN(CC1=CC=CC=C1)C)O |