| SpectraBase Compound ID | GGmlTIPWCwi |
|---|---|
| InChI | InChI=1S/C16H15IN2O3/c1-19(16(21)22-14-5-3-2-4-6-14)11-15(20)18-13-9-7-12(17)8-10-13/h2-10H,11H2,1H3,(H,18,20) |
| InChIKey | HZCURMDHZUNYRT-UHFFFAOYSA-N |
| Mol Weight | 410.21 g/mol |
| Molecular Formula | C16H15IN2O3 |
| Exact Mass | 410.012737 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D6knhlnaDy4 |
|---|---|
| Name | Glycine, N-methyl-N-phenoxycarbonyl-, N-(4-iodophenyl)amide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 410.012737348 u |
| Formula | C16H15IN2O3 |
| InChI | InChI=1S/C16H15IN2O3/c1-19(16(21)22-14-5-3-2-4-6-14)11-15(20)18-13-9-7-12(17)8-10-13/h2-10H,11H2,1H3,(H,18,20) |
| InChIKey | HZCURMDHZUNYRT-UHFFFAOYSA-N |
| Molecular Weight | 410.211 g/mol |
| SMILES | C1=CC(OC(=O)N(C)CC(NC2=CC=C(C=C2)I)=O)=CC=C1 |