| SpectraBase Compound ID | JDXmmfRtslm |
|---|---|
| InChI | InChI=1S/C9H6O4/c10-5-3-7(11)6-1-2-9(12)13-8(6)4-5/h1-4,10-11H |
| InChIKey | KIQQFVJHWNCGAU-UHFFFAOYSA-N |
| Mol Weight | 178.14 g/mol |
| Molecular Formula | C9H6O4 |
| Exact Mass | 178.026609 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9xEzMCHkYkR |
|---|---|
| Name | KIQQFVJHWNCGAU-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C9H6O4 |
| InChI | InChI=1S/C9H6O4/c10-5-3-7(11)6-1-2-9(12)13-8(6)4-5/h1-4,10-11H |
| InChIKey | KIQQFVJHWNCGAU-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 178.144 g/mol |
| Source File Reference | MHKO4284 |