| SpectraBase Compound ID | 4jLOhYlaajX |
|---|---|
| InChI | InChI=1S/C20H34O3/c1-13(2)16(21)6-8-18(3)10-11-20(5)17(23-20)7-9-19(4,22)15-12-14(15)18/h14-17,21-22H,1,6-12H2,2-5H3/t14-,15-,16?,17-,18-,19-,20-/m0/s1 |
| InChIKey | DTEVOGHFLLMVSL-RTILDTPDSA-N |
| Mol Weight | 322.5 g/mol |
| Molecular Formula | C20H34O3 |
| Exact Mass | 322.250795 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Lr0ONZSihtJ |
|---|---|
| Name | Pacificin D |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H34O3 |
| InChI | InChI=1S/C20H34O3/c1-13(2)16(21)6-8-18(3)10-11-20(5)17(23-20)7-9-19(4,22)15-12-14(15)18/h14-17,21-22H,1,6-12H2,2-5H3/t14-,15-,16?,17-,18-,19-,20-/m0/s1 |
| InChIKey | DTEVOGHFLLMVSL-RTILDTPDSA-N |
| Molecular Weight | 322.489 g/mol |
| SMILES | OC(CC[C@@]1([C@@]2([C@@]([C@](CC[C@@]3(O[C@]3(CC1)C)[H])(O)C)(C2)[H])[H])C)C(=C)C |
| SPLASH | splash10-001i-9011000000-91918a39e2099d6007e6 |
| Source of Spectrum | X2-68-77-4 |
| Wiley ID | 1609437 |