| SpectraBase Compound ID | 2OSs5XzJjom |
|---|---|
| InChI | InChI=1S/C19H14O5/c1-9(20)16-7-13-15(23-16)5-4-11-14-8-22-17-6-10(21)2-3-12(17)19(14)24-18(11)13/h2-7,14,19,21H,8H2,1H3 |
| InChIKey | RRVLNZLJKIPESL-UHFFFAOYSA-N |
| Mol Weight | 322.32 g/mol |
| Molecular Formula | C19H14O5 |
| Exact Mass | 322.084124 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3yOUbaxESOe |
|---|---|
| Name | Crotafuran B |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H14O5 |
| InChI | InChI=1S/C19H14O5/c1-9(20)16-7-13-15(23-16)5-4-11-14-8-22-17-6-10(21)2-3-12(17)19(14)24-18(11)13/h2-7,14,19,21H,8H2,1H3 |
| InChIKey | RRVLNZLJKIPESL-UHFFFAOYSA-N |
| Molecular Weight | 322.316 g/mol |
| SMILES | Oc1ccc2C3Oc4c5cc(C(=O)C)oc5ccc4C3COc2c1 |
| SPLASH | splash10-05gi-2509000000-f283e0fc7a7b7f1fd933 |
| Source of Spectrum | H-85-851-2 |
| Wiley ID | 1524225 |