| SpectraBase Compound ID | JKY6kODAMHY |
|---|---|
| InChI | InChI=1S/C12H14INO/c1-4-9(2)12(15)14(3)11-8-6-5-7-10(11)13/h4-8H,1-3H3/b9-4- |
| InChIKey | CGJITGSIAITIPI-WTKPLQERSA-N |
| Mol Weight | 315.15 g/mol |
| Molecular Formula | C12H14INO |
| Exact Mass | 315.012009 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ClkjMKgNDg5 |
|---|---|
| Name | N-(2'-Iodophenyl)-N-methyl-2-methyl-2-butenamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.012009074 u |
| Formula | C12H14INO |
| InChI | InChI=1S/C12H14INO/c1-4-9(2)12(15)14(3)11-8-6-5-7-10(11)13/h4-8H,1-3H3/b9-4- |
| InChIKey | CGJITGSIAITIPI-WTKPLQERSA-N |
| Molecular Weight | 315.154 g/mol |
| SMILES | C(N(C=1C(I)=CC=CC1)C)(\C(=C/C)C)=O |