| SpectraBase Compound ID | Lfce9lru2WX |
|---|---|
| InChI | InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1D |
| InChIKey | WPYMKLBDIGXBTP-MICDWDOJSA-N |
| Mol Weight | 123.13 g/mol |
| Molecular Formula | C7H5DO2 |
| Exact Mass | 123.043056 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3Fc2pmGOiN2 |
|---|---|
| Name | 4-Deuteriobenzoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H5DO2 |
| InChI | InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1D |
| InChIKey | WPYMKLBDIGXBTP-MICDWDOJSA-N |
| Molecular Weight | 123.129 g/mol |
| SMILES | OC(=O)c1ccc(cc1)[D] |
| SPLASH | splash10-0zor-9700000000-cc47f0a9d6eef0b44cdc |
| Source of Spectrum | C-87-3046-23 |
| Wiley ID | 1127834 |