| SpectraBase Compound ID | 5TRFxxx47C |
|---|---|
| InChI | InChI=1S/C17H24O5/c1-9-7-14-12(10(2)16(19)21-14)5-6-17(4)15(20-11(3)18)8-13(9)22-17/h7,10,12-15H,5-6,8H2,1-4H3/b9-7-/t10-,12+,13+,14-,15-,17+/m1/s1 |
| InChIKey | NKNLJCXMKIBHCM-KCHUTUQISA-N |
| Mol Weight | 308.37 g/mol |
| Molecular Formula | C17H24O5 |
| Exact Mass | 308.162374 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Ft295K7he4N |
|---|---|
| Name | Caruifolin A - acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H24O5 |
| InChI | InChI=1S/C17H24O5/c1-9-7-14-12(10(2)16(19)21-14)5-6-17(4)15(20-11(3)18)8-13(9)22-17/h7,10,12-15H,5-6,8H2,1-4H3/b9-7-/t10-,12+,13+,14-,15-,17+/m1/s1 |
| InChIKey | NKNLJCXMKIBHCM-KCHUTUQISA-N |
| Molecular Weight | 308.374 g/mol |
| SMILES | C1(O[C@@]2(\C=C/([C@@]3(C[C@]([C@](CC[C@]2([C@]1(C)[H])[H])(O3)C)(OC(=O)C)[H])[H])C)[H])=O |
| SPLASH | splash10-00l2-0090000000-e3ad2e935e6dc7159fd5 |
| Source of Spectrum | G4-63-1629-2 |
| Wiley ID | 1608694 |