| SpectraBase Compound ID | CDxS8Kiy0k7 |
|---|---|
| InChI | InChI=1S/C11H8O4/c1-14-10(12)8-6-7-4-2-3-5-9(7)15-11(8)13/h2-6H,1H3 |
| InChIKey | JZAJARGAUOHFCU-UHFFFAOYSA-N |
| Mol Weight | 204.18 g/mol |
| Molecular Formula | C11H8O4 |
| Exact Mass | 204.042259 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ICxFwGkjSZ4 |
|---|---|
| Name | METHYL COUMARIN-3-CARBOXYLATE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H8O4 |
| InChI | InChI=1S/C11H8O4/c1-14-10(12)8-6-7-4-2-3-5-9(7)15-11(8)13/h2-6H,1H3 |
| InChIKey | JZAJARGAUOHFCU-UHFFFAOYSA-N |
| Molecular Weight | 204.0420 |
| SMILES | c1cc2OC(=O)C(C(OC)=O)=Cc2cc1 |
| SPLASH | splash10-0h2s-9510000000-b1ddcfb68db2c8f265ed |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |