| SpectraBase Compound ID | IUflDD24k5g |
|---|---|
| InChI | InChI=1S/C21H34O3/c1-14(12-19(23)24-6)10-11-20(4)16(3)17(22)13-21(5)15(2)8-7-9-18(20)21/h12,15,17-18,22H,3,7-11,13H2,1-2,4-6H3/b14-12+/t15-,17-,18?,20-,21-/m0/s1 |
| InChIKey | VEXFGATYUIZMEQ-CBHHFWSNSA-N |
| Mol Weight | 334.5 g/mol |
| Molecular Formula | C21H34O3 |
| Exact Mass | 334.250795 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A4ncMCPNhvS |
|---|---|
| Name | 7.beta.-Hydroxy-cleroda-8(170,13(E)-dien-15-oic Acid - Methyl Ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H34O3 |
| InChI | InChI=1S/C21H34O3/c1-14(12-19(23)24-6)10-11-20(4)16(3)17(22)13-21(5)15(2)8-7-9-18(20)21/h12,15,17-18,22H,3,7-11,13H2,1-2,4-6H3/b14-12+/t15-,17-,18?,20-,21-/m0/s1 |
| InChIKey | VEXFGATYUIZMEQ-CBHHFWSNSA-N |
| Molecular Weight | 334.500 g/mol |
| SMILES | O[C@@]1(C([C@@](C2[C@@](C1)([C@@](C)(CCC2)[H])C)(CC\C(=C\C(=O)OC)C)C)=C)[H] |
| SPLASH | splash10-0a4l-9700000000-713fe0c010b9471d0747 |
| Source of Spectrum | X2-55-848-1 |
| Wiley ID | 1604533 |