| SpectraBase Compound ID | AonxPJZhy8S |
|---|---|
| InChI | InChI=1S/C19H28O3/c1-13-7-10-16-18(3,15(13)9-8-14(2)20)11-6-12-19(16,4)17(21)22-5/h8-9,15-16H,1,6-7,10-12H2,2-5H3/b9-8+/t15?,16?,18?,19-/m0/s1 |
| InChIKey | MSYAVAXHELTBKO-DAKMZRIASA-N |
| Mol Weight | 304.43 g/mol |
| Molecular Formula | C19H28O3 |
| Exact Mass | 304.203845 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5ujmBW1AvK4 |
|---|---|
| Name | Isopimaric acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H28O3 |
| InChI | InChI=1S/C19H28O3/c1-13-7-10-16-18(3,15(13)9-8-14(2)20)11-6-12-19(16,4)17(21)22-5/h8-9,15-16H,1,6-7,10-12H2,2-5H3/b9-8+/t15?,16?,18?,19-/m0/s1 |
| InChIKey | MSYAVAXHELTBKO-DAKMZRIASA-N |
| Molecular Weight | 304.430 g/mol |
| SMILES | C12(C([C@](C(=O)OC)(C)CCC2)CCC(C1\C=C\C(=O)C)=C)C |
| SPLASH | splash10-05fr-0900000000-61b2e7647c520319eb88 |
| Source of Spectrum | QA-46-822-8 |
| Wiley ID | 863217 |