| SpectraBase Compound ID | InWhBKZVPhO |
|---|---|
| InChI | InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)/i1D3 |
| InChIKey | ZEYHEAKUIGZSGI-FIBGUPNXSA-N |
| Mol Weight | 155.17 g/mol |
| Molecular Formula | C8H5D3O3 |
| Exact Mass | 155.066174 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J8CmxXxfKfW |
|---|---|
| Name | 4-(Trideuteriomethoxy)benzoic acid |
| CAS Registry Number | 27914-54-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5D3O3 |
| InChI | InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)/i1D3 |
| InChIKey | ZEYHEAKUIGZSGI-FIBGUPNXSA-N |
| Molecular Weight | 155.167 g/mol |
| SMILES | OC(c1ccc(cc1)OC([D])([D])[D])=O |
| SPLASH | splash10-0a4r-4900000000-6054079254ac682b3d0e |
| Source of Spectrum | O-20-83-4 |
| Wiley ID | 1148832 |