| SpectraBase Compound ID | DsfYCXDfLqT |
|---|---|
| InChI | InChI=1S/C20H14INO2/c21-13-9-11-14(12-10-13)22-20(23)19-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)19/h1-12,19H,(H,22,23) |
| InChIKey | GHMXQQKCIKBZAQ-UHFFFAOYSA-N |
| Mol Weight | 427.24 g/mol |
| Molecular Formula | C20H14INO2 |
| Exact Mass | 427.006924 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HTE16QyzyPz |
|---|---|
| Name | N-(4-Iodophenyl)-9H-xanthene-9-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 427.006923693 u |
| Formula | C20H14INO2 |
| InChI | InChI=1S/C20H14INO2/c21-13-9-11-14(12-10-13)22-20(23)19-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)19/h1-12,19H,(H,22,23) |
| InChIKey | GHMXQQKCIKBZAQ-UHFFFAOYSA-N |
| Molecular Weight | 427.241 g/mol |
| SMILES | N(C(C1C2=C(C=CC=C2)OC=2C1=CC=CC2)=O)C=1C=CC(=CC1)I |