| SpectraBase Compound ID | 9spfEo13oHu |
|---|---|
| InChI | InChI=1S/C15H22O3/c1-10-4-3-5-12(9-16)8-14-13(7-6-10)11(2)15(17)18-14/h4,8,11,13-14,16H,3,5-7,9H2,1-2H3/b10-4-,12-8-/t11?,13-,14+/m0/s1 |
| InChIKey | JWJOVYZAXACWBK-WURCWZLCSA-N |
| Mol Weight | 250.34 g/mol |
| Molecular Formula | C15H22O3 |
| Exact Mass | 250.156895 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KymZais4tBb |
|---|---|
| Name | Germacranolide isomer |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H22O3 |
| InChI | InChI=1S/C15H22O3/c1-10-4-3-5-12(9-16)8-14-13(7-6-10)11(2)15(17)18-14/h4,8,11,13-14,16H,3,5-7,9H2,1-2H3/b10-4-,12-8-/t11?,13-,14+/m0/s1 |
| InChIKey | JWJOVYZAXACWBK-WURCWZLCSA-N |
| Molecular Weight | 250.338 g/mol |
| SMILES | OC\C1=C/[C@]2(OC(C([C@@]2(CC\C(=C/CC1)C)[H])C)=O)[H] |
| SPLASH | splash10-014i-0090000000-fc678557456123f71583 |
| Source of Spectrum | SO-0-120-2 |
| Wiley ID | 1538803 |