| SpectraBase Compound ID | 86muWPMl6DB |
|---|---|
| InChI | InChI=1S/C9H8O4/c10-9(11)4-6-1-2-7-8(3-6)13-5-12-7/h1-3H,4-5H2,(H,10,11) |
| InChIKey | ODVLMCWNGKLROU-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 | 1ujmC0VD3m9 |
|---|---|
| Name | 3,4-Methylenedioxybenzeneacetic acid |
| Comments | MONAID: JP011446 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8O4 |
| InChI | InChI=1S/C9H8O4/c10-9(11)4-6-1-2-7-8(3-6)13-5-12-7/h1-3H,4-5H2,(H,10,11) |
| InChIKey | ODVLMCWNGKLROU-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| SMILES | OC(=O)Cc1ccc2c(c1)OCO2 |
| SPLASH | splash10-0019-0900000000-516d54abbb5c9512044f |
| Source of Spectrum | SRH-2022-11446-0 |
| Wiley ID | 1833033 |