SpectraBase Compound ID | fjdpx5CpOC |
---|---|
InChI | InChI=1S/C28H20N4O2/c1-34-28(33)18-4-2-17(3-5-18)27-25-12-10-23(31-25)15-21-8-6-19(29-21)14-20-7-9-22(30-20)16-24-11-13-26(27)32-24/h2-16,29,32H,1H3/b19-14-,20-14-,21-15-,22-16-,23-15-,24-16-,27-25-,27-26- |
InChIKey | GXLBUAAOXWKBIJ-YTIBFTMPSA-N |
Mol Weight | 444.49 g/mol |
Molecular Formula | C28H20N4O2 |
Exact Mass | 444.158626 g/mol |
SpectraBase Spectrum ID | BWYhYl1h464 |
---|---|
Name | 5-(4-Methoxycarbonylphenyl)porphyrin |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C28H20N4O2 |
InChI | InChI=1S/C28H20N4O2/c1-34-28(33)18-4-2-17(3-5-18)27-25-12-10-23(31-25)15-21-8-6-19(29-21)14-20-7-9-22(30-20)16-24-11-13-26(27)32-24/h2-16,29,32H,1H3/b19-14-,20-14-,21-15-,22-16-,23-15-,24-16-,27-25-,27-26- |
InChIKey | GXLBUAAOXWKBIJ-YTIBFTMPSA-N |
Molecular Weight | 444.494 g/mol |
SMILES | [nH]1c2cc3nc(cc4[nH]c(cc5nc(c(c1cc2)-c1ccc(C(=O)OC)cc1)cc5)cc4)cc3 |
SPLASH | splash10-0006-0000900000-947177a87c564feef055 |
Source of Spectrum | U1-2010-247-9 |
Wiley ID | 1663759 |