| SpectraBase Compound ID | Ghll3WEI0JV |
|---|---|
| InChI | InChI=1S/C21H18O5/c1-3-10-7-8-11-13(18(10)22)9-14-17(20(11)24)21(25)16-12(19(14)23)5-4-6-15(16)26-2/h4-6,9-10,24H,3,7-8H2,1-2H3 |
| InChIKey | PYOUHENNUTXCQM-UHFFFAOYSA-N |
| Mol Weight | 350.37 g/mol |
| Molecular Formula | C21H18O5 |
| Exact Mass | 350.115424 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LkFBSHw8BgE |
|---|---|
| Name | (+-)-6-Hydroxy-4-methoxy-9-ethyl-7,8,9,1o-tetrahydronaphthacen-5,10,12-trione |
| Alternate Name(s) | 1,6,11(2H)-Naphthacenetrione, 2-ethyl-3,4-dihydro-5-hydroxy-7-methoxy- (+-)-6-Hydroxy-4-methoxy-9-ethyl-7,8,9,10-tetrahydronaphthacen-5,10,12-trione 9-Ethyl-6-hydroxy-4-methoxy-7,8,9,10-tetrahydronaphthacen-5,10,12-trione 2-Ethyl-5-hydroxy-7-methoxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione 7,8-Dihydro-4-methoxy-6-hydroxy-9-ethyl-5,10,12(9H)-naphthacenetrione 2-Ethyl-7-methoxy-5-oxidanyl-3,4-dihydro-2H-tetracene-1,6,11-trione |
| CAS Registry Number | 78773-02-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H18O5 |
| InChI | InChI=1S/C21H18O5/c1-3-10-7-8-11-13(18(10)22)9-14-17(20(11)24)21(25)16-12(19(14)23)5-4-6-15(16)26-2/h4-6,9-10,24H,3,7-8H2,1-2H3 |
| InChIKey | PYOUHENNUTXCQM-UHFFFAOYSA-N |
| Molecular Weight | 350.370 g/mol |
| SMILES | Oc1c2C(c3c(OC)cccc3C(c2cc2c1CCC(CC)C2=O)=O)=O |
| SPLASH | splash10-0uk9-0009000000-e1194f594a1484e43c25 |
| Source of Spectrum | QB-19-1062-17 |
| Wiley ID | 842048 |