| SpectraBase Compound ID | 3gZT44S5zJW |
|---|---|
| InChI | InChI=1S/C20H30ClNO5/c1-9-11(6-14(24)10-5-16(25)22-18(10)27)20(4)8-12(21)17(26)19(2,3)15(20)7-13(9)23/h10-15,17,23-24,26H,1,5-8H2,2-4H3,(H,22,25,27)/t10-,11+,12-,13+,14+,15+,17+,20-/m1/s1 |
| InChIKey | UACZEBODXTXUMI-VVHTYQJQSA-N |
| Mol Weight | 399.92 g/mol |
| Molecular Formula | C20H30ClNO5 |
| Exact Mass | 399.181251 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 41h0gqCxARO |
|---|---|
| Name | 3-BETA-HYDROXYCHLOROLISSOCLIMIDE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H30ClNO5 |
| InChI | InChI=1S/C20H30ClNO5/c1-9-11(6-14(24)10-5-16(25)22-18(10)27)20(4)8-12(21)17(26)19(2,3)15(20)7-13(9)23/h10-15,17,23-24,26H,1,5-8H2,2-4H3,(H,22,25,27)/t10-,11+,12-,13+,14+,15+,17+,20-/m1/s1 |
| InChIKey | UACZEBODXTXUMI-VVHTYQJQSA-N |
| Literature Reference Author | X.FU,A.J.PALOMAR,E.P.HONG,F.J.SCHMITZ,F.A.VALERIOTE |
| Literature Reference Citation | J.NAT.PROD.,67,1415(2004) |
| Literature Reference DOI | 10.1021/np0499620 |
| Molecular Weight | 399.915 g/mol |
| Solvent | CD2Cl2:CD3OD=2:1 |
| Source File Reference | UWMZ7400 |