| SpectraBase Compound ID | I9kiCbqOInW |
|---|---|
| InChI | InChI=1S/C16H16INO/c1-10-8-11(2)15(12(3)9-10)18-16(19)13-4-6-14(17)7-5-13/h4-9H,1-3H3,(H,18,19) |
| InChIKey | AUEFLYGUULOHDS-UHFFFAOYSA-N |
| Mol Weight | 365.21 g/mol |
| Molecular Formula | C16H16INO |
| Exact Mass | 365.027659 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 49206BDMe7u |
|---|---|
| Name | 4-Iodo-N-(2,4,6-trimethyl-phenyl)-benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 365.027659138 u |
| Formula | C16H16INO |
| InChI | InChI=1S/C16H16INO/c1-10-8-11(2)15(12(3)9-10)18-16(19)13-4-6-14(17)7-5-13/h4-9H,1-3H3,(H,18,19) |
| InChIKey | AUEFLYGUULOHDS-UHFFFAOYSA-N |
| Molecular Weight | 365.214 g/mol |
| SMILES | C1(NC(C2=CC=C(I)C=C2)=O)=C(C=C(C=C1C)C)C |