| SpectraBase Compound ID | 7y4t1nxC4qs |
|---|---|
| InChI | InChI=1S/C33H42N2O9/c1-38-22-7-8-23(25(34)16-22)18-9-10-35-17-20-14-28(31(42-5)29(33(37)43-6)24(20)15-21(35)11-18)44-32(36)19-12-26(39-2)30(41-4)27(13-19)40-3/h7-8,11-13,16,20-21,24,28-29,31H,9-10,14-15,17,34H2,1-6H3/t20-,21-,24+,28-,29+,31+/m1/s1 |
| InChIKey | HGETUWYWRJCXST-KXJLHWQRSA-N |
| Mol Weight | 610.7 g/mol |
| Molecular Formula | C33H42N2O9 |
| Exact Mass | 610.289031 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JrEyqDEfb8s |
|---|---|
| Name | HGETUWYWRJCXST-KXJLHWQRSA-N |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H42N2O9 |
| InChI | InChI=1S/C33H42N2O9/c1-38-22-7-8-23(25(34)16-22)18-9-10-35-17-20-14-28(31(42-5)29(33(37)43-6)24(20)15-21(35)11-18)44-32(36)19-12-26(39-2)30(41-4)27(13-19)40-3/h7-8,11-13,16,20-21,24,28-29,31H,9-10,14-15,17,34H2,1-6H3/t20-,21-,24+,28-,29+,31+/m1/s1 |
| InChIKey | HGETUWYWRJCXST-KXJLHWQRSA-N |
| Literature Reference Author | M.BERNER,A.TOLVANEN,M.LOUNASMAA,R.JOKELA |
| Literature Reference Citation | HETEROCYCLES,51,2941(1999) |
| Literature Reference DOI | 10.3987/COM-99-8718 |
| Molecular Weight | 610.704 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP7052 |