| SpectraBase Compound ID | CPgBf56sdTI |
|---|---|
| InChI | InChI=1S/C9H8O4/c1-11-8(10)9-12-6-4-2-3-5-7(6)13-9/h2-5,9H,1H3 |
| InChIKey | YXXQQTKETXOUEX-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 | 9joUM28e8g3 |
|---|---|
| Name | 1,3-BENZODIOXOLE-2-CARBOXYLIC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H8O4 |
| InChI | InChI=1S/C9H8O4/c1-11-8(10)9-12-6-4-2-3-5-7(6)13-9/h2-5,9H,1H3 |
| InChIKey | YXXQQTKETXOUEX-UHFFFAOYSA-N |
| Molecular Weight | 180.0420 |
| SMILES | c12OC(C(OC)=O)Oc1cccc2 |
| SPLASH | splash10-00di-9800000000-324a60f8f20186b331f9 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |