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2,4-Diethyl-7-[2-methoxycarbonyl)ethyl]-1,3,5,8-tetramethylporphyrin
SpectraBase Compound ID 66y8IG4Rrwa
InChI InChI=1S/C32H36N4O2/c1-8-22-19(5)28-16-31-23(9-2)18(4)26(35-31)15-27-20(6)24(10-11-32(37)38-7)29(34-27)13-21-12-17(3)25(33-21)14-30(22)36-28/h12-16,33,35H,8-11H2,1-7H3/b21-13-,25-14-,26-15-,27-15-,28-16-,29-13-,30-14-,31-16-
InChIKey XJXDAJCYIJKXQE-RWEZSQKASA-N
Mol Weight 508.7 g/mol
Molecular Formula C32H36N4O2
Exact Mass 508.283826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HDgNy1ojWwo
Name 2,4-Diethyl-7-[2-methoxycarbonyl)ethyl]-1,3,5,8-tetramethylporphyrin
CAS Registry Number 5174-83-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H36N4O2
InChI InChI=1S/C32H36N4O2/c1-8-22-19(5)28-16-31-23(9-2)18(4)26(35-31)15-27-20(6)24(10-11-32(37)38-7)29(34-27)13-21-12-17(3)25(33-21)14-30(22)36-28/h12-16,33,35H,8-11H2,1-7H3/b21-13-,25-14-,26-15-,27-15-,28-16-,29-13-,30-14-,31-16-
InChIKey XJXDAJCYIJKXQE-RWEZSQKASA-N
Molecular Weight 508.666 g/mol
SMILES [nH]1c2cc(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4C)CCC(=O)OC)c(c3CC)C)c(c1CC)C)C
SPLASH splash10-0a4i-0000490000-be3c10adb009f46d4439
Source of Spectrum J-49-4607-0
Synonyms 8,13-Diethyl-3,7,12,17-tetramethyl-21H,23H-porphine-2-propanoic acid methyl Methyl 3-[10,15-diethyl-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-4-yl]propanoate
Wiley ID 1400236