| SpectraBase Compound ID | WJH5LggWn5 |
|---|---|
| InChI | InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3 |
| InChIKey | BGEBZHIAGXMEMV-UHFFFAOYSA-N |
| Mol Weight | 216.19 g/mol |
| Molecular Formula | C12H8O4 |
| Exact Mass | 216.042259 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I3CIFev0Gc |
|---|---|
| Name | Bergapten |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H8O4 |
| InChI | InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3 |
| InChIKey | BGEBZHIAGXMEMV-UHFFFAOYSA-N |
| Molecular Weight | 216.192 g/mol |
| SMILES | c12cc3c(C=CC(O3)=O)c(c1cco2)OC |
| SPLASH | splash10-014i-0690000000-30d16ab68bfc3c7b208b |
| Source of Spectrum | QA-50-177-9 |
| Synonyms | 4-Methoxy-7H-furo[3,2-g]chromen-7-one |
| Wiley ID | 1795741 |