| SpectraBase Compound ID | 1uJkZ0mOOGD |
|---|---|
| InChI | InChI=1S/C13H17NO/c1-10(14-3)9-13(15)11(2)12-7-5-4-6-8-12/h4-9,11,14H,1-3H3/b10-9+ |
| InChIKey | SBYVHBBZGCLWQO-MDZDMXLPSA-N |
| Mol Weight | 203.28 g/mol |
| Molecular Formula | C13H17NO |
| Exact Mass | 203.131014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3kxWA9WZAji |
|---|---|
| Name | (E)-5-(Methylamino)-2-phenyl-4-hexen-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 203.131014170 u |
| Formula | C13H17NO |
| InChI | InChI=1S/C13H17NO/c1-10(14-3)9-13(15)11(2)12-7-5-4-6-8-12/h4-9,11,14H,1-3H3/b10-9+ |
| InChIKey | SBYVHBBZGCLWQO-MDZDMXLPSA-N |
| Molecular Weight | 203.285 g/mol |
| SMILES | C(\C=C/(NC)C)(C(C1=CC=CC=C1)C)=O |