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Phenylsulphonato[2,3,7,8,12,13,17,18-octaethylporphyrinato]indium
SpectraBase Compound ID 6WLK9SgxGCE
InChI InChI=1S/C36H44N4.C6H6O3S.In/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;7-10(8,9)6-4-2-1-3-5-6;/h17-20H,9-16H2,1-8H3;1-5H,(H,7,8,9);/q-2;;+3/p-1/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;
InChIKey AAILPEFCJNJHEZ-YAJYDHHFSA-M
Mol Weight 804.8 g/mol
Molecular Formula C42H49InN4O3S
Exact Mass 804.256416 g/mol
Parent InChIKey XEOYDIAONPWAHI-MUZKIALCSA-M
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Source of Spectrum KA-1980-2084-2
Unknown Identification

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