| SpectraBase Compound ID | Jx1PBE9y7Uk |
|---|---|
| InChI | InChI=1S/C13H8O4/c14-10-5-6-12(15)11(7-10)8-1-3-9(4-2-8)13(16)17/h1-7H,(H,16,17) |
| InChIKey | NPIYULNKQVGPNM-UHFFFAOYSA-N |
| Mol Weight | 228.2 g/mol |
| Molecular Formula | C13H8O4 |
| Exact Mass | 228.042259 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | jTTRrdNM8e |
|---|---|
| Name | 4-(1,4-BENZOQUINONYL)BENZOIC ACID |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H8O4 |
| InChI | InChI=1S/C13H8O4/c14-10-5-6-12(15)11(7-10)8-1-3-9(4-2-8)13(16)17/h1-7H,(H,16,17) |
| InChIKey | NPIYULNKQVGPNM-UHFFFAOYSA-N |
| Molecular Weight | 228.0420 |
| SMILES | OC(=O)c1ccc(C=2C(=O)C=CC(=O)C2)cc1 |
| SPLASH | splash10-0ugi-9500000000-1e9a5cc8a21e83697e5f |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |