![5-[3-(Dimethylamino)propyl]-10,20-diphenylporphyrin](/api/spectrum/Hb4lICvqRPN/structure.png?h=300&w=458 "5-[3-(Dimethylamino)propyl]-10,20-diphenylporphyrin")
| SpectraBase Compound ID | IPyEBfR4Qjj |
|---|---|
| InChI | InChI=1S/C37H33N5/c1-42(2)23-9-14-29-30-19-21-34(40-30)36(25-10-5-3-6-11-25)32-17-15-27(38-32)24-28-16-18-33(39-28)37(26-12-7-4-8-13-26)35-22-20-31(29)41-35/h3-8,10-13,15-22,24,38,41H,9,14,23H2,1-2H3/b27-24-,28-24-,30-29-,31-29-,36-32-,36-34-,37-33-,37-35- |
| InChIKey | YEQXTGLIGMZQOD-MFQFVVPWSA-N |
| Mol Weight | 547.7 g/mol |
| Molecular Formula | C37H33N5 |
| Exact Mass | 547.273596 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hb4lICvqRPN |
|---|---|
| Name | 5-[3-(Dimethylamino)propyl]-10,20-diphenylporphyrin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 547.273596083 u |
| Formula | C37H33N5 |
| InChI | InChI=1S/C37H33N5/c1-42(2)23-9-14-29-30-19-21-34(40-30)36(25-10-5-3-6-11-25)32-17-15-27(38-32)24-28-16-18-33(39-28)37(26-12-7-4-8-13-26)35-22-20-31(29)41-35/h3-8,10-13,15-22,24,38,41H,9,14,23H2,1-2H3/b27-24-,28-24-,30-29-,31-29-,36-32-,36-34-,37-33-,37-35- |
| InChIKey | YEQXTGLIGMZQOD-MFQFVVPWSA-N |
| Molecular Weight | 547.706 g/mol |
| SMILES | C1=C2NC(C=C2)=C(C2=NC(C=C2)=C(C=2NC(=CC2)C(=C2N=C1C=C2)C1=CC=CC=C1)CCCN(C)C)C1=CC=CC=C1 |