| SpectraBase Compound ID | AvABFahUCix |
|---|---|
| InChI | InChI=1S/C9H8O4/c1-12-7-3-6(10)2-5-4-13-9(11)8(5)7/h2-3,10H,4H2,1H3 |
| InChIKey | REIYIBBWPMFGGE-UHFFFAOYSA-N |
| Mol Weight | 180.16 g/mol |
| Molecular Formula | C9H8O4 |
| Exact Mass | 180.042259 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HFEare9Cx1P |
|---|---|
| Name | 3-Methoxy-5-hydroxy-2-oxophthalide |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8O4 |
| InChI | InChI=1S/C9H8O4/c1-12-7-3-6(10)2-5-4-13-9(11)8(5)7/h2-3,10H,4H2,1H3 |
| InChIKey | REIYIBBWPMFGGE-UHFFFAOYSA-N |
| Molecular Weight | 180.159 g/mol |
| SMILES | Oc1cc(c2c(COC2=O)c1)OC |
| SPLASH | splash10-0udi-0900000000-79c4166baf108e51d30c |
| Source of Spectrum | X2-48-297-9 |
| Wiley ID | 1601660 |