| SpectraBase Compound ID | 7en5rc22FqA |
|---|---|
| InChI | InChI=1S/C15H12O4/c1-7-3-9(16)4-13-10(7)5-11-8(2)15(18)12(17)6-14(11)19-13/h3-6,16,18H,1-2H3 |
| InChIKey | KDMSITAVXVGLMH-UHFFFAOYSA-N |
| Mol Weight | 256.26 g/mol |
| Molecular Formula | C15H12O4 |
| Exact Mass | 256.073559 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HMsArQVl3oC |
|---|---|
| Name | Echinotinctone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H12O4 |
| InChI | InChI=1S/C15H12O4/c1-7-3-9(16)4-13-10(7)5-11-8(2)15(18)12(17)6-14(11)19-13/h3-6,16,18H,1-2H3 |
| InChIKey | KDMSITAVXVGLMH-UHFFFAOYSA-N |
| Molecular Weight | 256.257 g/mol |
| SMILES | OC1=C(C=2C(Oc3c(c(cc(c3)O)C)C2)=CC1=O)C |
| SPLASH | splash10-0a4i-0090000000-d42b1c384d644376f10b |
| Source of Spectrum | SO-0-679-3 |
| Wiley ID | 877686 |