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5-(4-Hedadecyloxyphenyl)-10,15,20-triphenylporphyrin
SpectraBase Compound ID 785LWGOgaJt
InChI InChI=1S/C60H62N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-24-43-65-48-33-31-47(32-34-48)60-55-41-39-53(63-55)58(45-27-20-16-21-28-45)51-37-35-49(61-51)57(44-25-18-15-19-26-44)50-36-38-52(62-50)59(46-29-22-17-23-30-46)54-40-42-56(60)64-54/h15-23,25-42,61,64H,2-14,24,43H2,1H3/b57-49-,57-50-,58-51-,58-53-,59-52-,59-54-,60-55-,60-56-
InChIKey VDWTVVRAGVEPRD-NWQHMXIBSA-N
Mol Weight 855.2 g/mol
Molecular Formula C60H62N4O
Exact Mass 854.492363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GN8V4upyG6G
Name 5-(4-Hedadecyloxyphenyl)-10,15,20-triphenylporphyrin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C60H62N4O
InChI InChI=1S/C60H62N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-24-43-65-48-33-31-47(32-34-48)60-55-41-39-53(63-55)58(45-27-20-16-21-28-45)51-37-35-49(61-51)57(44-25-18-15-19-26-44)50-36-38-52(62-50)59(46-29-22-17-23-30-46)54-40-42-56(60)64-54/h15-23,25-42,61,64H,2-14,24,43H2,1H3/b57-49-,57-50-,58-51-,58-53-,59-52-,59-54-,60-55-,60-56-
InChIKey VDWTVVRAGVEPRD-NWQHMXIBSA-N
Molecular Weight 855.183 g/mol
SMILES [nH]1c2ccc1c(c1nc(c(c3[nH]c(c(c4nc(c2-c2ccccc2)cc4)-c2ccccc2)cc3)-c2ccccc2)cc1)-c1ccc(cc1)OCCCCCCCCCCCCCCCC
SPLASH splash10-007o-0000369000-cea144b48ed8aa30b33e
Source of Spectrum QB-11-172-3
Synonyms 12-[4-(hexadecyloxy)phenyl]-2,7,17-triphenyl-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-undecaene 5-(4-Hexadecyloxy-phenyl)-10,15,20-triphenyl-porphyrin
Wiley ID 840888