| SpectraBase Compound ID | EEwArkLnQVb |
|---|---|
| InChI | InChI=1S/C12H6Cl3NO3/c13-7-8(16-12(19)11(14)15)10(18)6-4-2-1-3-5(6)9(7)17/h1-4,11H,(H,16,19) |
| InChIKey | ZIEWAMOXCOLNSJ-UHFFFAOYSA-N |
| Mol Weight | 318.54 g/mol |
| Molecular Formula | C12H6Cl3NO3 |
| Exact Mass | 316.941326 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KAAkFXwjlyE |
|---|---|
| Name | Acetamide, 2,2-dichloro-N-(3-chloro-1,4-dihydro-1,4-dioxo-2-naphthalenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.941326154 u |
| Formula | C12H6Cl3NO3 |
| InChI | InChI=1S/C12H6Cl3NO3/c13-7-8(16-12(19)11(14)15)10(18)6-4-2-1-3-5(6)9(7)17/h1-4,11H,(H,16,19) |
| InChIKey | ZIEWAMOXCOLNSJ-UHFFFAOYSA-N |
| Molecular Weight | 318.543 g/mol |
| SMILES | C1(=C(Cl)C(=O)C=2C(C1=O)=CC=CC2)NC(C(Cl)Cl)=O |