| SpectraBase Compound ID | GTxDWzO2pd3 |
|---|---|
| InChI | InChI=1S/C21H33NO2/c1-13(2)14-6-10-19(3)16-7-11-20-9-4-5-15(20)21(19,12-8-17(23)24)18(14)22(16)20/h13-16,18H,4-12H2,1-3H3,(H,23,24)/t14-,15-,16+,18+,19+,20-,21+/m1/s1 |
| InChIKey | WONKRVWAUGXLFM-XDMKCASTSA-N |
| Mol Weight | 331.5 g/mol |
| Molecular Formula | C21H33NO2 |
| Exact Mass | 331.251129 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IUUMQK3jE0O |
|---|---|
| Name | CALDAPHNIDINE_M |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H33NO2 |
| InChI | InChI=1S/C21H33NO2/c1-13(2)14-6-10-19(3)16-7-11-20-9-4-5-15(20)21(19,12-8-17(23)24)18(14)22(16)20/h13-16,18H,4-12H2,1-3H3,(H,23,24)/t14-,15-,16+,18+,19+,20-,21+/m1/s1 |
| InChIKey | WONKRVWAUGXLFM-XDMKCASTSA-N |
| Literature Reference Author | C.R.ZHANG,S.P.YANG,J.M.YUE |
| Literature Reference Citation | J.NAT.PROD.,71,1663(2008) |
| Literature Reference DOI | 10.1021/np800323m |
| Molecular Weight | 331.499 g/mol |
| Sample ID | 29106 |
| Solvent | CD3OD |