| SpectraBase Compound ID | IMzeNa7Js5d |
|---|---|
| InChI | InChI=1S/C14H10ClNO4/c1-20-13-6-5-10(8-12(13)16(18)19)14(17)9-3-2-4-11(15)7-9/h2-8H,1H3 |
| InChIKey | BBKNLCMVMVDRJA-UHFFFAOYSA-N |
| Mol Weight | 291.69 g/mol |
| Molecular Formula | C14H10ClNO4 |
| Exact Mass | 291.029836 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6GmwSd1aZ8S |
|---|---|
| Name | (3-Chlorophenyl)(4-methoxy-3-nitrophenyl)methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.029835502 u |
| Formula | C14H10ClNO4 |
| InChI | InChI=1S/C14H10ClNO4/c1-20-13-6-5-10(8-12(13)16(18)19)14(17)9-3-2-4-11(15)7-9/h2-8H,1H3 |
| InChIKey | BBKNLCMVMVDRJA-UHFFFAOYSA-N |
| SMILES | C(=O)(C1=CC(N(=O)=O)=C(C=C1)OC)C1=CC(Cl)=CC=C1 |