2,4,7-Triethyl-6-[2-(methoxycarbonyl)vinyl]-1,3,5,8-tetramethylporphyrin

SpectraBase Compound ID	FBceewGrJ8h
InChI	InChI=1S/C34H38N4O2/c1-9-22-18(4)26-14-27-19(5)24(11-3)32(36-27)17-33-25(12-13-34(39)40-8)21(7)29(38-33)16-31-23(10-2)20(6)28(37-31)15-30(22)35-26/h12-17,35,38H,9-11H2,1-8H3/b13-12+,26-14-,27-14-,28-15-,29-16-,30-15-,31-16-,32-17-,33-17-
InChIKey	ILCHOVCFWMHKAU-ORYFOVPXSA-N Google Search
Mol Weight	534.7 g/mol
Molecular Formula	C34H38N4O2
Exact Mass	534.299476 g/mol

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SpectraBase Spectrum ID	HfMEUaWMqnk
Name	2,4,7-Triethyl-6-[2-(methoxycarbonyl)vinyl]-1,3,5,8-tetramethylporphyrin
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	534.299476478 u
Formula	C34H38N4O2
InChI	InChI=1S/C34H38N4O2/c1-9-22-18(4)26-14-27-19(5)24(11-3)32(36-27)17-33-25(12-13-34(39)40-8)21(7)29(38-33)16-31-23(10-2)20(6)28(37-31)15-30(22)35-26/h12-17,35,38H,9-11H2,1-8H3/b13-12+,26-14-,27-14-,28-15-,29-16-,30-15-,31-16-,32-17-,33-17-
InChIKey	ILCHOVCFWMHKAU-ORYFOVPXSA-N
Molecular Weight	534.704 g/mol
SMILES	C1=2N=C(C=C3NC(=CC4=NC(=CC=5NC(C2)=C(C5C)\C=C\C(=O)OC)C(=C4C)CC)C(=C3C)CC)C(=C1CC)C