| SpectraBase Compound ID | JRMghS9IvMX |
|---|---|
| InChI | InChI=1S/C35H48ClN3O10/c1-10-28(40)38(6)21(4)32(42)48-27-17-29(41)39(7)23-15-22(16-24(45-8)30(23)36)14-19(2)12-11-13-26(46-9)35(44)18-25(47-33(43)37-35)20(3)31-34(27,5)49-31/h11-13,15-16,20-21,25-27,31,44H,10,14,17-18H2,1-9H3,(H,37,43)/b13-11+,19-12+ |
| InChIKey | BVXGVRDMHBYRCQ-SZFRVYISSA-N |
| Mol Weight | 706.2 g/mol |
| Molecular Formula | C35H48ClN3O10 |
| Exact Mass | 705.302822 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LL0kHVpsNRv |
|---|---|
| Name | Maytanprine |
| Comments | reassigned |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C35H48ClN3O10 |
| InChI | InChI=1S/C35H48ClN3O10/c1-10-28(40)38(6)21(4)32(42)48-27-17-29(41)39(7)23-15-22(16-24(45-8)30(23)36)14-19(2)12-11-13-26(46-9)35(44)18-25(47-33(43)37-35)20(3)31-34(27,5)49-31/h11-13,15-16,20-21,25-27,31,44H,10,14,17-18H2,1-9H3,(H,37,43)/b13-11+,19-12+ |
| InChIKey | BVXGVRDMHBYRCQ-SZFRVYISSA-N |
| Instrument Name | Jeol FX-90 |
| Literature Reference | W.A. Wallace, A.T. Sneden, Org. Magn. Resonance 19, 31 (1982). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |