| SpectraBase Compound ID | 9Vv33hwPJUD |
|---|---|
| InChI | InChI=1S/C27H38O3/c1-20(2)9-6-13-24(19-28)14-8-12-21(3)10-7-11-22(4)15-16-25-18-26(29)23(5)17-27(25)30/h9-10,14-15,17-18,28H,6-8,11-13,16,19H2,1-5H3/b21-10+,22-15+,24-14- |
| InChIKey | AYWHRUOIEOXDRX-TZDKVAQASA-N |
| Mol Weight | 410.6 g/mol |
| Molecular Formula | C27H38O3 |
| Exact Mass | 410.282095 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Asjxy2cRM9g |
|---|---|
| Name | Chabrolobenzoquinone E |
| Appearance | Pale yellow oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H38O3 |
| InChI | InChI=1S/C27H38O3/c1-20(2)9-6-13-24(19-28)14-8-12-21(3)10-7-11-22(4)15-16-25-18-26(29)23(5)17-27(25)30/h9-10,14-15,17-18,28H,6-8,11-13,16,19H2,1-5H3/b21-10+,22-15+,24-14- |
| InChIKey | AYWHRUOIEOXDRX-TZDKVAQASA-N |
| Instrument Name | VG QUATTRO |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np050278a |
| Molecular Weight | 410.598 g/mol |
| Reported Formula | C27H38O3 |
| SMILES | OC\C(=C/CC\C(=C\CC\C(=C\CC=1C(C=C(C(C1)=O)C)=O)C)C)CCC=C(C)C |
| SPLASH | splash10-014i-9300000000-4fa5cca15b75a2beb4f6 |
| Source of Spectrum | G4-68-1655-2 |
| Wiley ID | 1879486 |