| SpectraBase Compound ID | 6NCsrVQE63 |
|---|---|
| InChI | InChI=1S/C9H10O3/c1-11-8-5-3-7(4-6-8)9(10)12-2/h3-6H,1-2H3/i2D3 |
| InChIKey | DDIZAANNODHTRB-BMSJAHLVSA-N |
| Mol Weight | 169.19 g/mol |
| Molecular Formula | C9H7D3O3 |
| Exact Mass | 169.081824 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8oWgD6JDKti |
|---|---|
| Name | Trideuterio methyl ester of 4-methoxybenzoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H7D3O3 |
| InChI | InChI=1S/C9H10O3/c1-11-8-5-3-7(4-6-8)9(10)12-2/h3-6H,1-2H3/i2D3 |
| InChIKey | DDIZAANNODHTRB-BMSJAHLVSA-N |
| Molecular Weight | 169.194 g/mol |
| SMILES | C(c1ccc(cc1)OC)(=O)OC([D])([D])[D] |
| SPLASH | splash10-000i-6900000000-5cb2399a1b4e489194b3 |
| Source of Spectrum | F-1977-361-0 |
| Wiley ID | 1162216 |