| SpectraBase Compound ID | 6qX4LEquMs2 |
|---|---|
| InChI | InChI=1S/C22H34O4/c1-12-11-22-9-6-15-20(3,4)8-7-17(26-13(2)23)21(15,5)16(22)10-14(24)18(12)19(22)25/h14-19,24-25H,1,6-11H2,2-5H3/t14-,15+,16-,17+,18?,19-,21+,22?/m0/s1/i14D |
| InChIKey | WZOVHVGBIHILAR-UIKVESFESA-N |
| Mol Weight | 363.5 g/mol |
| Molecular Formula | C22H33DO4 |
| Exact Mass | 363.251986 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6JwsByfMqbr |
|---|---|
| Name | ent-1.beta.-Acetoxy-12-.beta.-deutero-12.alpha.,14.alpha.-dihydroxykaur-16-ene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H33DO4 |
| InChI | InChI=1S/C22H34O4/c1-12-11-22-9-6-15-20(3,4)8-7-17(26-13(2)23)21(15,5)16(22)10-14(24)18(12)19(22)25/h14-19,24-25H,1,6-11H2,2-5H3/t14-,15+,16-,17+,18?,19-,21+,22?/m0/s1/i14D |
| InChIKey | WZOVHVGBIHILAR-UIKVESFESA-N |
| Molecular Weight | 363.516 g/mol |
| SMILES | O[C@]1(C2[C@](C[C@@]3(C1(CC[C@@]1(C(CC[C@]([C@@]31C)(OC(=O)C)[H])(C)C)[H])CC2=C)[H])(O)[D])[H] |
| SPLASH | splash10-0006-9000000000-9dbc70fca095101bf859 |
| Source of Spectrum | J-60-2173-15 |
| Wiley ID | 1349880 |