2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine iron(III) acetate

SpectraBase Compound ID	BaHSWziYSMP
InChI	InChI=1S/C36H44N4.C2H4O2.Fe/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-2(3)4;/h17-20H,9-16H2,1-8H3;1H3,(H,3,4);/q-2;;+3/p-1/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;
InChIKey	NDJCHCPGNRLRIA-YAJYDHHFSA-M Google Search
Mol Weight	647.7 g/mol
Molecular Formula	C38H47FeN4O2
Exact Mass	647.304838 g/mol

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SpectraBase Spectrum ID	906LAQ5YMdr
Name	2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine iron(III) acetate
Source of Sample	Aldrich
Catalog Number	381179
CAS Registry Number	41697-90-9
Copyright	Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C38H47FeN4O2
InChI	InChI=1S/C36H44N4.C2H4O2.Fe/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-2(3)4;/h17-20H,9-16H2,1-8H3;1H3,(H,3,4);/q-2;;+3/p-1/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;
InChIKey	NDJCHCPGNRLRIA-YAJYDHHFSA-M
Purity	97%
Wiley ID	SIAL_ATR-IR_017819