| SpectraBase Compound ID | AxuS0Rdh0KE |
|---|---|
| InChI | InChI=1S/C37H44N4O8/c1-18-22(9-13-32(42)48-7)28-17-29-23(10-14-33(43)49-8)19(2)25(39-29)16-27-21(4)35(37(45)41-27)31(47-6)12-11-30(46-5)34-20(3)26(40-36(34)44)15-24(18)38-28/h15-17,30-31,38H,9-14H2,1-8H3,(H,40,44)(H,41,45)/p+1/b26-15-,27-16-,29-17-/t30-,31-/m0/s1 |
| InChIKey | GVQHGNJOJXYJRK-WSWVWMPGSA-O |
| Mol Weight | 673.8 g/mol |
| Molecular Formula | C37H45N4O8 |
| Exact Mass | 673.323739 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Tl3KQPATFJ |
|---|---|
| Name | GVQHGNJOJXYJRK-WSWVWMPGSA-O |
| Compound Number | 2*(H+) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H45N4O8 |
| InChI | InChI=1S/C37H44N4O8/c1-18-22(9-13-32(42)48-7)28-17-29-23(10-14-33(43)49-8)19(2)25(39-29)16-27-21(4)35(37(45)41-27)31(47-6)12-11-30(46-5)34-20(3)26(40-36(34)44)15-24(18)38-28/h15-17,30-31,38H,9-14H2,1-8H3,(H,40,44)(H,41,45)/p+1/b26-15-,27-16-,29-17-/t30-,31-/m0/s1 |
| InChIKey | GVQHGNJOJXYJRK-WSWVWMPGSA-O |
| Literature Reference Author | D.KROIS |
| Literature Reference Citation | MH.CHEM.,122,495(1991) |
| Literature Reference DOI | 10.1007/BF00809802 |
| Molecular Weight | 673.786 g/mol |
| Solvent | CD3OD:CDCl3=9:1;C=0.02M |
| Source File Reference | UWCS21023 |