| SpectraBase Compound ID | IcJrlHdicgc |
|---|---|
| InChI | InChI=1S/C9H8ClNO4/c1-14-9-8(12)11(13)6-3-2-5(10)4-7(6)15-9/h2-4,9,13H,1H3 |
| InChIKey | WMYDLOLDKKOMJV-UHFFFAOYSA-N |
| Mol Weight | 229.62 g/mol |
| Molecular Formula | C9H8ClNO4 |
| Exact Mass | 229.014185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | WlCNqmBZ6p |
|---|---|
| Name | 2H-1,4-Benzoxazin-3(4H)-one, 7-chloro-4-hydroxy-2-methoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.014185438 u |
| Formula | C9H8ClNO4 |
| InChI | InChI=1S/C9H8ClNO4/c1-14-9-8(12)11(13)6-3-2-5(10)4-7(6)15-9/h2-4,9,13H,1H3 |
| InChIKey | WMYDLOLDKKOMJV-UHFFFAOYSA-N |
| Molecular Weight | 229.619 g/mol |
| SMILES | C1(N(C2=CC=C(C=C2OC1OC)Cl)O)=O |