![Hydroxy[2-oxocyclohexylidene]acetic acid](/api/spectrum/A929yLEAZBf/structure.png?h=300&w=458 "Hydroxy[2-oxocyclohexylidene]acetic acid")
| SpectraBase Compound ID | BDDhMC8Yau9 |
|---|---|
| InChI | InChI=1S/C8H10O4/c9-6-4-2-1-3-5(6)7(10)8(11)12/h10H,1-4H2,(H,11,12)/b7-5- |
| InChIKey | XBCBXUMOSIGDCP-ALCCZGGFSA-N |
| Mol Weight | 170.16 g/mol |
| Molecular Formula | C8H10O4 |
| Exact Mass | 170.057909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A929yLEAZBf |
|---|---|
| Name | Hydroxy[2-oxocyclohexylidene]acetic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.057908798 u |
| Formula | C8H10O4 |
| InChI | InChI=1S/C8H10O4/c9-6-4-2-1-3-5(6)7(10)8(11)12/h10H,1-4H2,(H,11,12)/b7-5- |
| InChIKey | XBCBXUMOSIGDCP-ALCCZGGFSA-N |
| SMILES | C(\C(=C\1C(=O)CCCC1)O)(=O)O |