| SpectraBase Compound ID | 468vc138ExS |
|---|---|
| InChI | InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10) |
| InChIKey | LOIYMIARKYCTBW-UHFFFAOYSA-N |
| Mol Weight | 138.13 g/mol |
| Molecular Formula | C6H6N2O2 |
| Exact Mass | 138.042927 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AuXhf1aYIdI |
|---|---|
| Name | Urocanic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6N2O2 |
| InChI | InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10) |
| InChIKey | LOIYMIARKYCTBW-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 138.126 g/mol |
| SMILES | [nH]1cc(C=CC(=O)O)nc1 |
| SPLASH | splash10-000f-9200000000-db402cf03fb54d50f4bd |
| Source of Spectrum | SRH-2022-9499-0 |
| Synonyms | 4-Imidazole-acrylic acid |
| Wiley ID | 1831156 |