| SpectraBase Compound ID | IHOi2sqZ2KB |
|---|---|
| InChI | InChI=1S/C15H10ClNO3/c16-11-7-5-10(6-8-11)9-17-13-4-2-1-3-12(13)14(18)20-15(17)19/h1-8H,9H2 |
| InChIKey | FUUMQIGBAYVFIX-UHFFFAOYSA-N |
| Mol Weight | 287.7 g/mol |
| Molecular Formula | C15H10ClNO3 |
| Exact Mass | 287.034921 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Gw5mcuYamj |
|---|---|
| Name | 1-(p-Chlorobenzyl)-2H-3,1-benzoxazine-2,4(1H)-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.034920883 u |
| Formula | C15H10ClNO3 |
| InChI | InChI=1S/C15H10ClNO3/c16-11-7-5-10(6-8-11)9-17-13-4-2-1-3-12(13)14(18)20-15(17)19/h1-8H,9H2 |
| InChIKey | FUUMQIGBAYVFIX-UHFFFAOYSA-N |
| SMILES | C=12C=CC=CC1N(C(OC2=O)=O)CC=1C=CC(=CC1)Cl |