| SpectraBase Compound ID | rG8GR5FYWU |
|---|---|
| InChI | InChI=1S/C22H34O3/c1-15(24)25-14-17-16(13-23)7-8-19-21(17,4)12-9-18-20(2,3)10-6-11-22(18,19)5/h7,13,17-19H,6,8-12,14H2,1-5H3/t17?,18?,19?,21-,22-/m0/s1 |
| InChIKey | JIALFXUXKBYDJT-QGSFHLTQSA-N |
| Mol Weight | 346.5 g/mol |
| Molecular Formula | C22H34O3 |
| Exact Mass | 346.250795 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HTHUkej5gmc |
|---|---|
| Name | (14S)-15-Acetoxy-Isoagath-12-en-16-al |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H34O3 |
| InChI | InChI=1S/C22H34O3/c1-15(24)25-14-17-16(13-23)7-8-19-21(17,4)12-9-18-20(2,3)10-6-11-22(18,19)5/h7,13,17-19H,6,8-12,14H2,1-5H3/t17?,18?,19?,21-,22-/m0/s1 |
| InChIKey | JIALFXUXKBYDJT-QGSFHLTQSA-N |
| Molecular Weight | 346.511 g/mol |
| SMILES | [C@]12(C([C@]3(CCCC(C3CC2)(C)C)C)CC=C(C1COC(=O)C)C=O)C |
| SPLASH | splash10-0udi-0469000000-cc2a29259aa3baf770dc |
| Source of Spectrum | X4-21-46-0 |
| Wiley ID | 1585795 |