| SpectraBase Compound ID | Ax8fRG6EbcQ |
|---|---|
| InChI | InChI=1S/C7H5NO4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)/i/hD |
| InChIKey | SLAMLWHELXOEJZ-DYCDLGHISA-N |
| Mol Weight | 168.13 g/mol |
| Molecular Formula | C7H4DNO4 |
| Exact Mass | 168.028134 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3Y3pm6celS2 |
|---|---|
| Name | o-Nitrobenzoic acid carboxyl-D1 |
| CAS Registry Number | 29809-20-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H4DNO4 |
| InChI | InChI=1S/C7H5NO4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)/i/hD |
| InChIKey | SLAMLWHELXOEJZ-DYCDLGHISA-N |
| Molecular Weight | 168.126 g/mol |
| SMILES | c1(N(=O)=O)c(C(=O)O[D])cccc1 |
| SPLASH | splash10-0gb9-9200000000-414d323c18f954ee2054 |
| Source of Spectrum | O-3-995-1 |
| Wiley ID | 14627 |