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5,15-Di(n-hexyl)porphyrin
SpectraBase Compound ID 9DxgJvE1toe
InChI InChI=1S/C32H38N4/c1-3-5-7-9-11-27-29-17-13-23(33-29)21-25-15-19-31(35-25)28(12-10-8-6-4-2)32-20-16-26(36-32)22-24-14-18-30(27)34-24/h13-22,33,36H,3-12H2,1-2H3/b23-21-,24-22-,25-21-,26-22-,29-27-,30-27-,31-28-,32-28-
InChIKey DLSGXTJTKXAMOC-APHWUJABSA-N
Mol Weight 478.7 g/mol
Molecular Formula C32H38N4
Exact Mass 478.309647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xhOHyDCdag
Name 5,15-Di(n-hexyl)porphyrin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H38N4
InChI InChI=1S/C32H38N4/c1-3-5-7-9-11-27-29-17-13-23(33-29)21-25-15-19-31(35-25)28(12-10-8-6-4-2)32-20-16-26(36-32)22-24-14-18-30(27)34-24/h13-22,33,36H,3-12H2,1-2H3/b23-21-,24-22-,25-21-,26-22-,29-27-,30-27-,31-28-,32-28-
InChIKey DLSGXTJTKXAMOC-APHWUJABSA-N
Molecular Weight 478.684 g/mol
SMILES [nH]1c2cc3nc(c(c4[nH]c(cc5nc(c(c1cc2)CCCCCC)cc5)cc4)CCCCCC)cc3
SPLASH splash10-004i-0001900000-3568737820dbefb204d7
Source of Spectrum KC-91-5545-20
Synonyms 5,15-Dihexylporphyrin 2,12-dihexyl-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 1629497