| SpectraBase Compound ID | 1WkmMa37swh |
|---|---|
| InChI | InChI=1S/C14H8BrNO2/c15-10-7-5-9(6-8-10)13-16-12-4-2-1-3-11(12)14(17)18-13/h1-8H |
| InChIKey | FIIDMKOKFYKKMG-UHFFFAOYSA-N |
| Mol Weight | 302.13 g/mol |
| Molecular Formula | C14H8BrNO2 |
| Exact Mass | 300.973841 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BbmxAvwLqIZ |
|---|---|
| Name | 4H-3,1-Benzoxazin-4-one, 2-(4-bromophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.973841500 u |
| Formula | C14H8BrNO2 |
| InChI | InChI=1S/C14H8BrNO2/c15-10-7-5-9(6-8-10)13-16-12-4-2-1-3-11(12)14(17)18-13/h1-8H |
| InChIKey | FIIDMKOKFYKKMG-UHFFFAOYSA-N |
| SMILES | C1(=O)OC(=NC2=C1C=CC=C2)C1=CC=C(C=C1)Br |