| SpectraBase Compound ID | 27a1LaC03I |
|---|---|
| InChI | InChI=1S/C9H7Cl3O2/c1-5-2-3-7(13)6(4-5)8(14)9(10,11)12/h2-4,13H,1H3 |
| InChIKey | KSMAFCBCOHZYHZ-UHFFFAOYSA-N |
| Mol Weight | 253.51 g/mol |
| Molecular Formula | C9H7Cl3O2 |
| Exact Mass | 251.951163 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6bF5NJRlXGX |
|---|---|
| Name | 4-Methyl-2-(trichloroacetyl)phenol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H7Cl3O2 |
| InChI | InChI=1S/C9H7Cl3O2/c1-5-2-3-7(13)6(4-5)8(14)9(10,11)12/h2-4,13H,1H3 |
| InChIKey | KSMAFCBCOHZYHZ-UHFFFAOYSA-N |
| Molecular Weight | 253.512 g/mol |
| SMILES | Oc1c(C(C(Cl)(Cl)Cl)=O)cc(cc1)C |
| SPLASH | splash10-000i-0910000000-78a118ff65cea87a0021 |
| Source of Spectrum | F-65-7544-4 |
| Wiley ID | 1680360 |