| SpectraBase Compound ID | 7QSzW5mW0eN |
|---|---|
| InChI | InChI=1S/C27H45N5O/c1-19(12-16-32-17-29-24-22(32)23(28)30(6)18-31(24)7)10-14-26(5)20(2)11-15-27(33)21(26)9-8-13-25(27,3)4/h12,17,20-21,28,33H,8-11,13-16,18H2,1-7H3/b19-12+,28-23? |
| InChIKey | UMYDEMPHXCZYBB-VRAKWYDISA-N |
| Mol Weight | 455.7 g/mol |
| Molecular Formula | C27H45N5O |
| Exact Mass | 455.362411 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CuwtoqD7Fpc |
|---|---|
| Name | AGELASIMINE-B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H45N5O |
| InChI | InChI=1S/C27H45N5O/c1-19(12-16-32-17-29-24-22(32)23(28)30(6)18-31(24)7)10-14-26(5)20(2)11-15-27(33)21(26)9-8-13-25(27,3)4/h12,17,20-21,28,33H,8-11,13-16,18H2,1-7H3/b19-12+,28-23? |
| InChIKey | UMYDEMPHXCZYBB-VRAKWYDISA-N |
| Literature Reference Author | R.FATHI-AFSHAR,T.M.ALLEN |
| Literature Reference Citation | CAN.J.CHEM.,66,45(1988) |
| Literature Reference DOI | 10.1139/v88-006 |
| Molecular Weight | 455.687 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED3522 |