| SpectraBase Compound ID | G2LLM3ME5EJ |
|---|---|
| InChI | InChI=1S/C8H7Cl3O/c1-7(8(9,10)11)4-2-6(12)3-5-7/h2-5H,1H3 |
| InChIKey | RCHALGLCCGJUAE-UHFFFAOYSA-N |
| Mol Weight | 225.5 g/mol |
| Molecular Formula | C8H7Cl3O |
| Exact Mass | 223.956248 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BCUfysilUPa |
|---|---|
| Name | 4-Methyl-4-trichlormethyl-2,5-cyclohexadien-1-on |
| CAS Registry Number | 3274-12-2 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H7Cl3O |
| InChI | InChI=1S/C8H7Cl3O/c1-7(8(9,10)11)4-2-6(12)3-5-7/h2-5H,1H3 |
| InChIKey | RCHALGLCCGJUAE-UHFFFAOYSA-N |
| Literature Reference | Liebigs Ann. Chem. 121 (1978). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |