| SpectraBase Compound ID | Couumc7duVL |
|---|---|
| InChI | InChI=1S/C20H14BrNO2/c21-13-6-5-7-14(12-13)22-20(23)19-15-8-1-3-10-17(15)24-18-11-4-2-9-16(18)19/h1-12,19H,(H,22,23) |
| InChIKey | CTXTZRVJGGHRQE-UHFFFAOYSA-N |
| Mol Weight | 380.24 g/mol |
| Molecular Formula | C20H14BrNO2 |
| Exact Mass | 379.020792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Lc1qsKf6Ma |
|---|---|
| Name | N-(3-Bromophenyl)-9H-xanthene-9-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 379.020791693 u |
| Formula | C20H14BrNO2 |
| InChI | InChI=1S/C20H14BrNO2/c21-13-6-5-7-14(12-13)22-20(23)19-15-8-1-3-10-17(15)24-18-11-4-2-9-16(18)19/h1-12,19H,(H,22,23) |
| InChIKey | CTXTZRVJGGHRQE-UHFFFAOYSA-N |
| Molecular Weight | 380.241 g/mol |
| SMILES | N(C(C1C2=C(C=CC=C2)OC=2C1=CC=CC2)=O)C1=CC(Br)=CC=C1 |