| SpectraBase Compound ID | AXCryF7SKor |
|---|---|
| InChI | InChI=1S/C20H26O3/c1-12(2)13-5-6-15-14(9-13)16(22)10-17-19(15,3)8-7-18(23)20(17,4)11-21/h5-6,9,12,17,21H,7-8,10-11H2,1-4H3/t17-,19-,20-/m1/s1 |
| InChIKey | AILBGNUDAQUSML-MISYRCLQSA-N |
| Mol Weight | 314.43 g/mol |
| Molecular Formula | C20H26O3 |
| Exact Mass | 314.188195 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LPUj3mVqhY5 |
|---|---|
| Name | Triptobenzene N |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H26O3 |
| InChI | InChI=1S/C20H26O3/c1-12(2)13-5-6-15-14(9-13)16(22)10-17-19(15,3)8-7-18(23)20(17,4)11-21/h5-6,9,12,17,21H,7-8,10-11H2,1-4H3/t17-,19-,20-/m1/s1 |
| InChIKey | AILBGNUDAQUSML-MISYRCLQSA-N |
| Molecular Weight | 314.425 g/mol |
| SMILES | OC[C@@]1([C@]2([C@@](c3c(cc(cc3)C(C)C)C(C2)=O)(CCC1=O)C)[H])C |
| SPLASH | splash10-002g-1890000000-718bc6240bbf7370fae8 |
| Source of Spectrum | G4-62-1524-3 |
| Synonyms | (1S,4aS,10aR)-1-(hydroxymethyl)-1,4a-dimethyl-7-propan-2-yl-3,4,10,10a-tetrahydrophenanthrene-2,9-dione (1S,4aS,10aR)-1-(hydroxymethyl)-7-isopropyl-1,4a-dimethyl-3,4,10,10a-tetrahydrophenanthrene-2,9-dione (1S,4aS,10aR)-7-isopropyl-1,4a-dimethyl-1-methylol-3,4,10,10a-tetrahydrophenanthrene-2,9-quinone |
| Wiley ID | 1608130 |