| SpectraBase Compound ID | 8XNzFSpKhs2 |
|---|---|
| InChI | InChI=1S/C7H6N2O7/c1-15-6(11)3-5(10)4(7(12)16-2)9(14)8(3)13/h1-2H3 |
| InChIKey | FDSGBUOTAIYGID-UHFFFAOYSA-N |
| Mol Weight | 230.13 g/mol |
| Molecular Formula | C7H6N2O7 |
| Exact Mass | 230.017501 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4yiPPLc2uKM |
|---|---|
| Name | 4H-Pyrazole-3,5-dicarboxylic acid, 4-oxo-, dimethyl ester, 1,2-dioxide |
| CAS Registry Number | 17952-98-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H6N2O7 |
| InChI | InChI=1S/C7H6N2O7/c1-15-6(11)3-5(10)4(7(12)16-2)9(14)8(3)13/h1-2H3 |
| InChIKey | FDSGBUOTAIYGID-UHFFFAOYSA-N |
| Molecular Weight | 230.132 g/mol |
| SMILES | COC(=O)C=1C(=O)[C-](C(OC)=O)[N+]([N+]1[O-])=O |
| SPLASH | splash10-0006-9200000000-2c9be59ddcf4501d5313 |
| Source of Spectrum | Y-13-987-0 |
| Synonyms | 3,5-bis(methoxycarbonyl)-2-oxido-1,4-dioxo-4,5-dihydro-1H-1,2-pyrazol-2-ium-1-ylium-5-ide 3,5-Dimethoxy carbonyl-4-oxo-4H-pyrazole 1,2-dioxide 1,2-Dioxido-4-oxopyrazole-1,2-diium-3,5-dicarboxylic acid dimethyl ester Dimethyl 1,2-dioxido-4-oxopyrazole-1,2-diium-3,5-dicarboxylate Dimethyl 1,2-dioxido-4-oxo-pyrazole-1,2-diium-3,5-dicarboxylate Dimethyl 1,2-bis(oxidanidyl)-4-oxidanylidene-pyrazole-1,2-diium-3,5-dicarboxylate NSC 236245 |
| Wiley ID | 1231108 |