| SpectraBase Compound ID | 9mZNAW4YcjW |
|---|---|
| InChI | InChI=1S/C33H39ClN2O9/c1-39-19-7-8-21-22(14-19)35-30-23-15-20-18(16-36(23)10-9-33(21,30)34)13-26(29(43-5)27(20)32(38)44-6)45-31(37)17-11-24(40-2)28(42-4)25(12-17)41-3/h7-8,11-12,14,18,20,23,26-27,29H,9-10,13,15-16H2,1-6H3 |
| InChIKey | PHCRRLDBUHLVMD-UHFFFAOYSA-N |
| Mol Weight | 643.1 g/mol |
| Molecular Formula | C33H39ClN2O9 |
| Exact Mass | 642.234409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LEuxzoZxsBe |
|---|---|
| Name | 9-CHLORO-9H-RESERPINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H39ClN2O9 |
| InChI | InChI=1S/C33H39ClN2O9/c1-39-19-7-8-21-22(14-19)35-30-23-15-20-18(16-36(23)10-9-33(21,30)34)13-26(29(43-5)27(20)32(38)44-6)45-31(37)17-11-24(40-2)28(42-4)25(12-17)41-3/h7-8,11-12,14,18,20,23,26-27,29H,9-10,13,15-16H2,1-6H3 |
| InChIKey | PHCRRLDBUHLVMD-UHFFFAOYSA-N |
| Literature Reference Author | D.V.C.AWANG,A.VINCENT,D.KINDACK |
| Literature Reference Citation | CAN.J.CHEM.,62,2667(1984) |
| Literature Reference DOI | 10.1139/v84-453 |
| Molecular Weight | 643.134 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED3588 |