| SpectraBase Compound ID | AgIpmEXjj6f |
|---|---|
| InChI | InChI=1S/C9H8O5/c1-3-5-4(2-14-9(5)13)7(11)8(12)6(3)10/h10-12H,2H2,1H3 |
| InChIKey | RABLYBQDMDORFH-UHFFFAOYSA-N |
| Mol Weight | 196.16 g/mol |
| Molecular Formula | C9H8O5 |
| Exact Mass | 196.037173 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | MluoK6gaYy |
|---|---|
| Name | 4,5,6-TRIHYDROXY-7-METHYL-PHTHALIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C9H8O5 |
| InChI | InChI=1S/C9H8O5/c1-3-5-4(2-14-9(5)13)7(11)8(12)6(3)10/h10-12H,2H2,1H3 |
| InChIKey | RABLYBQDMDORFH-UHFFFAOYSA-N |
| Literature Reference Citation | MOLECULES,17,4219(2012) |
| Literature Reference DOI | 10.3390/molecules17044219 |
| Molecular Weight | 196.160 g/mol |
| Sample ID | 1717 |
| Solvent | CD3OD |