| SpectraBase Compound ID | Cs9PlxsIgcR |
|---|---|
| InChI | InChI=1S/C15H22O4/c1-13(2)5-4-6-14(3)11(13)10(16)7-9-8-19-12(17)15(9,14)18/h7,10-11,16,18H,4-6,8H2,1-3H3/t10-,11+,14+,15+/m1/s1 |
| InChIKey | ITJIJDWFGMAIKB-PKIAMQTDSA-N |
| Mol Weight | 266.34 g/mol |
| Molecular Formula | C15H22O4 |
| Exact Mass | 266.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4M3uMEcgArP |
|---|---|
| Name | Strobilactone A |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.151809184 u |
| Formula | C15H22O4 |
| InChI | InChI=1S/C15H22O4/c1-13(2)5-4-6-14(3)11(13)10(16)7-9-8-19-12(17)15(9,14)18/h7,10-11,16,18H,4-6,8H2,1-3H3/t10-,11+,14+,15+/m1/s1 |
| InChIKey | ITJIJDWFGMAIKB-PKIAMQTDSA-N |
| Molecular Weight | 266.337 g/mol |
| SMILES | C1(OCC=2[C@]1([C@@]1([C@@]([C@@](C2)(O)[H])(C(CCC1)(C)C)[H])C)O)=O |