![2-Chloro-3-[(3-nitrophenyl)amino]naphthalene-1,4-dione](/api/spectrum/8IaHOjLUW2y/structure.png?h=300&w=458 "2-Chloro-3-[(3-nitrophenyl)amino]naphthalene-1,4-dione")
| SpectraBase Compound ID | 7SshMmfIGxt |
|---|---|
| InChI | InChI=1S/C16H9ClN2O4/c17-13-14(18-9-4-3-5-10(8-9)19(22)23)16(21)12-7-2-1-6-11(12)15(13)20/h1-8,18H |
| InChIKey | BTTSBROSCNLVBK-UHFFFAOYSA-N |
| Mol Weight | 328.71 g/mol |
| Molecular Formula | C16H9ClN2O4 |
| Exact Mass | 328.025084 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8IaHOjLUW2y |
|---|---|
| Name | 2-Chloro-3-[(3-nitrophenyl)amino]naphthalene-1,4-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.025084474 u |
| Formula | C16H9ClN2O4 |
| InChI | InChI=1S/C16H9ClN2O4/c17-13-14(18-9-4-3-5-10(8-9)19(22)23)16(21)12-7-2-1-6-11(12)15(13)20/h1-8,18H |
| InChIKey | BTTSBROSCNLVBK-UHFFFAOYSA-N |
| Molecular Weight | 328.711 g/mol |
| SMILES | C1(C2=C(C=CC=C2)C(C(=C1Cl)NC1=CC(=CC=C1)N(=O)=O)=O)=O |