![1H-Imidazole, 4,5-dichloro-1-[(4-phenoxyphenyl)methyl]-](/api/spectrum/5TSogcaHSTD/structure.png?h=300&w=458 "1H-Imidazole, 4,5-dichloro-1-[(4-phenoxyphenyl)methyl]-")
| SpectraBase Compound ID | 33M1qBETKXa |
|---|---|
| InChI | InChI=1S/C16H12Cl2N2O/c17-15-16(18)20(11-19-15)10-12-6-8-14(9-7-12)21-13-4-2-1-3-5-13/h1-9,11H,10H2 |
| InChIKey | LBBODSRHJQWYHT-UHFFFAOYSA-N |
| Mol Weight | 319.19 g/mol |
| Molecular Formula | C16H12Cl2N2O |
| Exact Mass | 318.032668 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5TSogcaHSTD |
|---|---|
| Name | 1H-Imidazole, 4,5-dichloro-1-[(4-phenoxyphenyl)methyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.032668413 u |
| Formula | C16H12Cl2N2O |
| InChI | InChI=1S/C16H12Cl2N2O/c17-15-16(18)20(11-19-15)10-12-6-8-14(9-7-12)21-13-4-2-1-3-5-13/h1-9,11H,10H2 |
| InChIKey | LBBODSRHJQWYHT-UHFFFAOYSA-N |
| Molecular Weight | 319.191 g/mol |
| SMILES | C=1N(C(=C(N1)Cl)Cl)CC1=CC=C(C=C1)OC1=CC=CC=C1 |