| SpectraBase Compound ID | 1FzxRaCHD2P |
|---|---|
| InChI | InChI=1S/C22H27NO4/c1-11-9-21-10-14(25)16-20(2)4-3-5-22(16)17(21)15(26)12(11)8-13(21)18(22)23(6-7-24)19(20)27/h12-13,16-18,24H,1,3-10H2,2H3/t12-,13-,16+,17-,18-,20+,21-,22+/m0/s1 |
| InChIKey | SOOGRVQQQMCVQZ-CBQACLFYSA-N |
| Mol Weight | 369.46 g/mol |
| Molecular Formula | C22H27NO4 |
| Exact Mass | 369.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GFlRYSHqbm9 |
|---|---|
| Name | Thalicsessine |
| CAS Registry Number | 113807-86-6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C22H27NO4 |
| InChI | InChI=1S/C22H27NO4/c1-11-9-21-10-14(25)16-20(2)4-3-5-22(16)17(21)15(26)12(11)8-13(21)18(22)23(6-7-24)19(20)27/h12-13,16-18,24H,1,3-10H2,2H3/t12-,13-,16+,17-,18-,20+,21-,22+/m0/s1 |
| InChIKey | SOOGRVQQQMCVQZ-CBQACLFYSA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | Heterocycles 26, 943 (1987). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |