| SpectraBase Compound ID | 6G0GBVCOPkB |
|---|---|
| InChI | InChI=1S/C14H19NO2/c1-11(9-13(16)10-14(2,3)17)15-12-7-5-4-6-8-12/h4-9,15,17H,10H2,1-3H3/b11-9+ |
| InChIKey | ZSWBZABXEFZJAD-PKNBQFBNSA-N |
| Mol Weight | 233.31 g/mol |
| Molecular Formula | C14H19NO2 |
| Exact Mass | 233.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 99zNZlErYBe |
|---|---|
| Name | (2E)-2-Anilino-6-hydroxy-6-methyl-2-hepten-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.141578854 u |
| Formula | C14H19NO2 |
| InChI | InChI=1S/C14H19NO2/c1-11(9-13(16)10-14(2,3)17)15-12-7-5-4-6-8-12/h4-9,15,17H,10H2,1-3H3/b11-9+ |
| InChIKey | ZSWBZABXEFZJAD-PKNBQFBNSA-N |
| Molecular Weight | 233.311 g/mol |
| SMILES | C=1(N\C(=C\C(CC(O)(C)C)=O)C)C=CC=CC1 |