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5-Hexyl-10,15,20-tris(3-hydroxyphenyl)porphyrin
SpectraBase Compound ID 8h6X9ZpSPf
InChI InChI=1S/C44H38N4O3/c1-2-3-4-5-15-33-34-16-18-36(45-34)42(27-9-6-12-30(49)24-27)38-20-22-40(47-38)44(29-11-8-14-32(51)26-29)41-23-21-39(48-41)43(37-19-17-35(33)46-37)28-10-7-13-31(50)25-28/h6-14,16-26,45,48-51H,2-5,15H2,1H3/b34-33-,35-33-,42-36-,42-38-,43-37-,43-39-,44-40-,44-41-
InChIKey ARAGSATZZJOAOS-UDYGMXFRSA-N
Mol Weight 670.8 g/mol
Molecular Formula C44H38N4O3
Exact Mass 670.294391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fvUmKmGWra
Name 5-Hexyl-10,15,20-tris(3-hydroxyphenyl)porphyrin
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Formula C44H38N4O3
InChI InChI=1S/C44H38N4O3/c1-2-3-4-5-15-33-34-16-18-36(45-34)42(27-9-6-12-30(49)24-27)38-20-22-40(47-38)44(29-11-8-14-32(51)26-29)41-23-21-39(48-41)43(37-19-17-35(33)46-37)28-10-7-13-31(50)25-28/h6-14,16-26,45,48-51H,2-5,15H2,1H3/b34-33-,35-33-,42-36-,42-38-,43-37-,43-39-,44-40-,44-41-
InChIKey ARAGSATZZJOAOS-UDYGMXFRSA-N
Molecular Weight 670.813 g/mol
SMILES [nH]1c2c(-c3cc(ccc3)O)c3nc(c(c4ccc(c(c5nc(c(c1cc2)-c1cc(O)ccc1)cc5)CCCCCC)[nH]4)-c1cc(O)ccc1)cc3
SPLASH splash10-00di-0000029000-685000d9c1baf7967e34
Source of Spectrum KC-61-5562-88
Synonyms 3-[7-hexyl-12,17-bis(3-hydroxyphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenol
Wiley ID 1629544