| SpectraBase Compound ID | 98XsvHuIiD1 |
|---|---|
| InChI | InChI=1S/C12H12Cl2O2/c1-12(2,3)9-5-7(10(13)15)4-8(6-9)11(14)16/h4-6H,1-3H3 |
| InChIKey | PEZDGINXZHEJFN-UHFFFAOYSA-N |
| Mol Weight | 259.13 g/mol |
| Molecular Formula | C12H12Cl2O2 |
| Exact Mass | 258.021435 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | D61U7k2PFBN |
|---|---|
| Name | 5-tert-Butylbenzene-1,3-dicarbonyl chloride |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12Cl2O2 |
| InChI | InChI=1S/C12H12Cl2O2/c1-12(2,3)9-5-7(10(13)15)4-8(6-9)11(14)16/h4-6H,1-3H3 |
| InChIKey | PEZDGINXZHEJFN-UHFFFAOYSA-N |
| Molecular Weight | 259.132 g/mol |
| SMILES | c1(C(=O)Cl)cc(C(=O)Cl)cc(c1)C(C)(C)C |
| SPLASH | splash10-00dl-0090000000-73d5be7236c129cb058a |
| Source of Spectrum | H-82-754-4 |
| Wiley ID | 815481 |