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10-Hexyl-5,15-bis(3,5-dimethoxyphenyl)porphyrin
SpectraBase Compound ID IFmATtw3xT8
InChI InChI=1S/C42H42N4O4/c1-6-7-8-9-10-34-35-15-17-39(45-35)41(26-19-30(47-2)24-31(20-26)48-3)37-13-11-28(43-37)23-29-12-14-38(44-29)42(40-18-16-36(34)46-40)27-21-32(49-4)25-33(22-27)50-5/h11-25,43,46H,6-10H2,1-5H3/b28-23-,29-23-,35-34-,36-34-,41-37-,41-39-,42-38-,42-40-
InChIKey HWIKAGUPZDHUAT-OHPJMEMZSA-N
Mol Weight 666.8 g/mol
Molecular Formula C42H42N4O4
Exact Mass 666.320606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GZoe63lOjnJ
Name 10-Hexyl-5,15-bis(3,5-dimethoxyphenyl)porphyrin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H42N4O4
InChI InChI=1S/C42H42N4O4/c1-6-7-8-9-10-34-35-15-17-39(45-35)41(26-19-30(47-2)24-31(20-26)48-3)37-13-11-28(43-37)23-29-12-14-38(44-29)42(40-18-16-36(34)46-40)27-21-32(49-4)25-33(22-27)50-5/h11-25,43,46H,6-10H2,1-5H3/b28-23-,29-23-,35-34-,36-34-,41-37-,41-39-,42-38-,42-40-
InChIKey HWIKAGUPZDHUAT-OHPJMEMZSA-N
Molecular Weight 666.822 g/mol
SMILES [nH]1c2cc3nc(c(c4[nH]c(c(c5nc(c(c1cc2)-c1cc(OC)cc(c1)OC)cc5)CCCCCC)cc4)-c1cc(OC)cc(c1)OC)cc3
SPLASH splash10-014i-0001029000-1d69d0929724fa942e0e
Source of Spectrum KC-91-5549-35
Synonyms 2,12-bis(3,5-dimethoxyphenyl)-17-hexyl-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
Wiley ID 1629482