| SpectraBase Compound ID | 21YTySs765G |
|---|---|
| InChI | InChI=1S/C12H12O5/c1-14-7-4-5-8-9(6-7)17-12(13)11(16-3)10(8)15-2/h4-6H,1-3H3 |
| InChIKey | AYMSWLVOSROJFX-UHFFFAOYSA-N |
| Mol Weight | 236.22 g/mol |
| Molecular Formula | C12H12O5 |
| Exact Mass | 236.068473 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 87TdRLgqoMP |
|---|---|
| Name | 3,4,7-Trimethoxycoumarin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O5 |
| InChI | InChI=1S/C12H12O5/c1-14-7-4-5-8-9(6-7)17-12(13)11(16-3)10(8)15-2/h4-6H,1-3H3 |
| InChIKey | AYMSWLVOSROJFX-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 236.223 g/mol |
| SMILES | COc1ccc2c(c1)OC(C(=C2OC)OC)=O |
| SPLASH | splash10-000f-2960000000-e6a0da9e90e0e2d9c209 |
| Source of Spectrum | SRH-2022-3130-0 |
| Wiley ID | 1825462 |