| SpectraBase Compound ID | H4nNiEYXD8j |
|---|---|
| InChI | InChI=1S/C21H24O8/c1-9(2)19(25)27-14-6-10(3)15-13(24)7-12(8-22)16(15)18-17(14)21(5,20(26)28-18)29-11(4)23/h7,14,16-18,22H,1,6,8H2,2-5H3/t14-,16+,17+,18-,21-/m0/s1 |
| InChIKey | SGOTVEBFZHNFHE-YTBPQBKGSA-N |
| Mol Weight | 404.42 g/mol |
| Molecular Formula | C21H24O8 |
| Exact Mass | 404.147118 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1JJrI9s4klZ |
|---|---|
| Name | Ferupennin K |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H24O8 |
| InChI | InChI=1S/C21H24O8/c1-9(2)19(25)27-14-6-10(3)15-13(24)7-12(8-22)16(15)18-17(14)21(5,20(26)28-18)29-11(4)23/h7,14,16-18,22H,1,6,8H2,2-5H3/t14-,16+,17+,18-,21-/m0/s1 |
| InChIKey | SGOTVEBFZHNFHE-YTBPQBKGSA-N |
| Instrument Name | JEOL JMSD-300 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np020014d |
| Molecular Weight | 404.415 g/mol |
| Optical Rotation | [a]D = +4.0 (c = 0.3, CHCl3) |
| Reported Formula | C21H24O8 |
| SMILES | OCC=1[C@@]2(C(=C(C[C@@]([C@@]3([C@]2(OC([C@]3(OC(=O)C)C)=O)[H])[H])(OC(C(=C)C)=O)[H])C)C(C1)=O)[H] |
| SPLASH | splash10-0imu-9761200000-87e1ec82647c6a9ed01d |
| Source of Spectrum | G4-65-1902-11 |
| Wiley ID | 1883522 |