| SpectraBase Compound ID | 9wBXtMTrsBo |
|---|---|
| InChI | InChI=1S/C22H32O3/c1-14-11-22-12-16(14)6-7-17(22)21(4)9-5-8-20(3,13-25-15(2)23)18(21)10-19(22)24/h11,16-18H,5-10,12-13H2,1-4H3/t16-,17?,18?,20-,21+,22+/m1/s1 |
| InChIKey | XQISZABFQYFFLA-KCDSHWNCSA-N |
| Mol Weight | 344.5 g/mol |
| Molecular Formula | C22H32O3 |
| Exact Mass | 344.235145 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2SwDoWIqz4E |
|---|---|
| Name | (ent)-18-(Acetoxy)kaur-15-en-7-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H32O3 |
| InChI | InChI=1S/C22H32O3/c1-14-11-22-12-16(14)6-7-17(22)21(4)9-5-8-20(3,13-25-15(2)23)18(21)10-19(22)24/h11,16-18H,5-10,12-13H2,1-4H3/t16-,17?,18?,20-,21+,22+/m1/s1 |
| InChIKey | XQISZABFQYFFLA-KCDSHWNCSA-N |
| Molecular Weight | 344.495 g/mol |
| SMILES | [C@@]123C([C@@]4(CCC[C@@](C4CC3=O)(COC(=O)C)C)C)CC[C@](C2)(C(=C1)C)[H] |
| SPLASH | splash10-00kf-0059000000-6a04ee06c349354ef830 |
| Source of Spectrum | X2-53-443-8 |
| Wiley ID | 1603478 |