| SpectraBase Compound ID | LF6ENUvKWEK |
|---|---|
| InChI | InChI=1S/C17H20O5/c1-7-5-11(19)13-8(2)6-12(21-10(4)18)15-9(3)17(20)22-16(15)14(7)13/h5,9,12,14-16H,6H2,1-4H3/t9-,12+,14?,15-,16-/m1/s1 |
| InChIKey | QONYNSMAVSRIRD-RMXGYAAHSA-N |
| Mol Weight | 304.34 g/mol |
| Molecular Formula | C17H20O5 |
| Exact Mass | 304.131074 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HwAeGT3WHZ2 |
|---|---|
| Name | 8.alpha.-Acetoxyachillin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H20O5 |
| InChI | InChI=1S/C17H20O5/c1-7-5-11(19)13-8(2)6-12(21-10(4)18)15-9(3)17(20)22-16(15)14(7)13/h5,9,12,14-16H,6H2,1-4H3/t9-,12+,14?,15-,16-/m1/s1 |
| InChIKey | QONYNSMAVSRIRD-RMXGYAAHSA-N |
| Molecular Weight | 304.342 g/mol |
| SMILES | C12[C@]3(OC(=O)[C@@]([C@@]3([C@@](OC(=O)C)(CC(=C1C(=O)C=C2C)C)[H])[H])(C)[H])[H] |
| SPLASH | splash10-0udi-0986000000-2fd4f56b61de5b6b248e |
| Source of Spectrum | X2-44-727-6 |
| Wiley ID | 1600904 |