| SpectraBase Compound ID | IjnQ03GeWTg |
|---|---|
| InChI | InChI=1S/C21H25NO7/c1-21(2)27-9-11(29-21)17-13-12(10-7-5-4-6-8-10)16(23)15-18(26-3)19(24)22(15)14(13)20(25)28-17/h4-8,11-18,23H,9H2,1-3H3/t11-,12+,13+,14-,15+,16-,17-,18-/m1/s1 |
| InChIKey | FOWFBCRBWIUIGL-ZKOUFSPNSA-N |
| Mol Weight | 403.43 g/mol |
| Molecular Formula | C21H25NO7 |
| Exact Mass | 403.163102 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CTjIN1xMmKL |
|---|---|
| Name | FOWFBCRBWIUIGL-ZKOUFSPNSA-N |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H25NO7 |
| InChI | InChI=1S/C21H25NO7/c1-21(2)27-9-11(29-21)17-13-12(10-7-5-4-6-8-10)16(23)15-18(26-3)19(24)22(15)14(13)20(25)28-17/h4-8,11-18,23H,9H2,1-3H3/t11-,12+,13+,14-,15+,16-,17-,18-/m1/s1 |
| InChIKey | FOWFBCRBWIUIGL-ZKOUFSPNSA-N |
| Literature Reference Author | G.RUANO,M.GRANDE,J.ANAYA |
| Literature Reference Citation | J.ORG.CHEM.,67,8243(2002) |
| Literature Reference DOI | 10.1021/jo026066p |
| Molecular Weight | 403.432 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS24744 |