| SpectraBase Compound ID | 717VZ1kDYAd |
|---|---|
| InChI | InChI=1S/C12H8Cl2N2O2/c13-9-2-1-8(10(14)5-9)7-18-12(17)11-6-15-3-4-16-11/h1-6H,7H2 |
| InChIKey | MZVIDTRUBYBBJY-UHFFFAOYSA-N |
| Mol Weight | 283.11 g/mol |
| Molecular Formula | C12H8Cl2N2O2 |
| Exact Mass | 281.996283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G3NXB7tOZBC |
|---|---|
| Name | 2,4-Dichlorobenzyl 2-pyrazinecarboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.996282904 u |
| Formula | C12H8Cl2N2O2 |
| InChI | InChI=1S/C12H8Cl2N2O2/c13-9-2-1-8(10(14)5-9)7-18-12(17)11-6-15-3-4-16-11/h1-6H,7H2 |
| InChIKey | MZVIDTRUBYBBJY-UHFFFAOYSA-N |
| Molecular Weight | 283.114 g/mol |
| SMILES | C1(C(OCC2=C(C=C(C=C2)Cl)Cl)=O)=NC=CN=C1 |