| SpectraBase Compound ID | 8d9GeAIctI7 |
|---|---|
| InChI | InChI=1S/C36H38N4O4/c1-9-23-19(3)27-15-28-21(5)25(11-13-35(41)43-7)33(39-28)18-34-26(12-14-36(42)44-8)22(6)30(40-34)17-32-24(10-2)20(4)29(38-32)16-31(23)37-27/h9-10,15-18,37,40H,1-2,11-14H2,3-8H3/b27-15-,28-15-,29-16-,30-17-,31-16-,32-17-,33-18-,34-18- |
| InChIKey | WASRLAPXOHTNAX-MFBGAUBSSA-N |
| Mol Weight | 590.7 g/mol |
| Molecular Formula | C36H38N4O4 |
| Exact Mass | 590.289306 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KR9nf0Fj8Cb |
|---|---|
| Name | Protoporphyrin-ix dimethyl ester |
| CAS Registry Number | 5522-66-7 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C36H38N4O4 |
| InChI | InChI=1S/C36H38N4O4/c1-9-23-19(3)27-15-28-21(5)25(11-13-35(41)43-7)33(39-28)18-34-26(12-14-36(42)44-8)22(6)30(40-34)17-32-24(10-2)20(4)29(38-32)16-31(23)37-27/h9-10,15-18,37,40H,1-2,11-14H2,3-8H3/b27-15-,28-15-,29-16-,30-17-,31-16-,32-17-,33-18-,34-18- |
| InChIKey | WASRLAPXOHTNAX-MFBGAUBSSA-N |
| Instrument Name | Varian XL-100 |
| Literature Reference | A.R. Battersby, G.L. Hodgson, M.Ihara, J. Chem. Soc. Perkin I 2923 (1973). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |