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5-Hexyl-15-(4-hydroxyphenyl)-10,20-diphenylporphyrin
SpectraBase Compound ID uQDcx633Nu
InChI InChI=1S/C44H38N4O/c1-2-3-4-11-16-33-34-21-23-36(45-34)42(29-12-7-5-8-13-29)38-25-27-40(47-38)44(31-17-19-32(49)20-18-31)41-28-26-39(48-41)43(30-14-9-6-10-15-30)37-24-22-35(33)46-37/h5-10,12-15,17-28,45,48-49H,2-4,11,16H2,1H3/b34-33-,35-33-,42-36-,42-38-,43-37-,43-39-,44-40-,44-41-
InChIKey YCWQSBNIIZLMIK-UDYGMXFRSA-N
Mol Weight 638.8 g/mol
Molecular Formula C44H38N4O
Exact Mass 638.304562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4AOWSQxJUy6
Name 5-Hexyl-15-(4-hydroxyphenyl)-10,20-diphenylporphyrin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H38N4O
InChI InChI=1S/C44H38N4O/c1-2-3-4-11-16-33-34-21-23-36(45-34)42(29-12-7-5-8-13-29)38-25-27-40(47-38)44(31-17-19-32(49)20-18-31)41-28-26-39(48-41)43(30-14-9-6-10-15-30)37-24-22-35(33)46-37/h5-10,12-15,17-28,45,48-49H,2-4,11,16H2,1H3/b34-33-,35-33-,42-36-,42-38-,43-37-,43-39-,44-40-,44-41-
InChIKey YCWQSBNIIZLMIK-UDYGMXFRSA-N
Molecular Weight 638.815 g/mol
SMILES [nH]1c2c(-c3ccc(cc3)O)c3nc(c(c4ccc(c(c5nc(c(c1cc2)-c1ccccc1)cc5)CCCCCC)[nH]4)-c1ccccc1)cc3
SPLASH splash10-014r-0004097000-8b9c67e8d6c16aabab5e
Source of Spectrum KC-91-5555-64
Synonyms 4-[12-hexyl-7,17-diphenyl-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-2-yl]phenol
Wiley ID 1629463