| SpectraBase Compound ID | 4bCk5ud12L2 |
|---|---|
| InChI | InChI=1S/C23H31NO4/c1-14(2)7-5-8-15(3)9-6-10-23(4)20(26)12-17-19(25)11-16-18(21(17)28-23)13-24-22(16)27/h7,9,11,20,25-26H,5-6,8,10,12-13H2,1-4H3,(H,24,27)/b15-9+/t20-,23-/m0/s1 |
| InChIKey | XGUHYRYUXUVLOK-BHNVPJQESA-N |
| Mol Weight | 385.5 g/mol |
| Molecular Formula | C23H31NO4 |
| Exact Mass | 385.225308 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FxweLkiqrbK |
|---|---|
| Name | STACHYBOTRIN-B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H31NO4 |
| InChI | InChI=1S/C23H31NO4/c1-14(2)7-5-8-15(3)9-6-10-23(4)20(26)12-17-19(25)11-16-18(21(17)28-23)13-24-22(16)27/h7,9,11,20,25-26H,5-6,8,10,12-13H2,1-4H3,(H,24,27)/b15-9+/t20-,23-/m0/s1 |
| InChIKey | XGUHYRYUXUVLOK-BHNVPJQESA-N |
| Literature Reference Author | X.XU,F.S.DEGUZMAN,J.B.GLOER,C.A.SHEARER |
| Literature Reference Citation | J.ORG.CHEM.,57,6700(1992) |
| Literature Reference DOI | 10.1021/jo00051a006 |
| Molecular Weight | 385.503 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS6587 |