| SpectraBase Compound ID | GmjfORvqyd6 |
|---|---|
| InChI | InChI=1S/C18H14O4/c1-9-4-3-5-12-11(9)6-7-13-15(19)14-10(2)8-21-17(14)18(20)22-16(12)13/h3-7,10H,8H2,1-2H3 |
| InChIKey | NCZCGETXIBWAHE-UHFFFAOYSA-N |
| Mol Weight | 294.31 g/mol |
| Molecular Formula | C18H14O4 |
| Exact Mass | 294.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1T6prV79GGk |
|---|---|
| Name | Tanshinketolactone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H14O4 |
| InChI | InChI=1S/C18H14O4/c1-9-4-3-5-12-11(9)6-7-13-15(19)14-10(2)8-21-17(14)18(20)22-16(12)13/h3-7,10H,8H2,1-2H3 |
| InChIKey | NCZCGETXIBWAHE-UHFFFAOYSA-N |
| Molecular Weight | 294.306 g/mol |
| SMILES | C1=2C(c3c(c4cccc(c4cc3)C)OC(C2OCC1C)=O)=O |
| SPLASH | splash10-0002-0090000000-98b57f99b82c0b64cd46 |
| Source of Spectrum | QA-43-200-1 |
| Wiley ID | 862188 |