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2,7,12,18-Tetramethyl-3,8-diethyl-13,17-bis(3-morpholinopropyl)porphyrin
SpectraBase Compound ID DXgjBhh3AZn
InChI InChI=1S/C42H56N6O2/c1-7-31-27(3)35-23-36-29(5)33(11-9-13-47-15-19-49-20-16-47)41(45-36)26-42-34(12-10-14-48-17-21-50-22-18-48)30(6)38(46-42)25-40-32(8-2)28(4)37(44-40)24-39(31)43-35/h23-26,43,46H,7-22H2,1-6H3/b35-23-,36-23-,37-24-,38-25-,39-24-,40-25-,41-26-,42-26-
InChIKey KYZUQWPLKHFMSF-XGAKKYBISA-N
Mol Weight 677.0 g/mol
Molecular Formula C42H56N6O2
Exact Mass 676.446475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5gYF3nATS2r
Name 2,7,12,18-Tetramethyl-3,8-diethyl-13,17-bis(3-morpholinopropyl)porphyrin
Alternate Name(s) 4,19-diethyl-5,9,15,20-tetramethyl-10,14-bis[3-(4-morpholinyl)propyl]-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
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Formula C42H56N6O2
InChI InChI=1S/C42H56N6O2/c1-7-31-27(3)35-23-36-29(5)33(11-9-13-47-15-19-49-20-16-47)41(45-36)26-42-34(12-10-14-48-17-21-50-22-18-48)30(6)38(46-42)25-40-32(8-2)28(4)37(44-40)24-39(31)43-35/h23-26,43,46H,7-22H2,1-6H3/b35-23-,36-23-,37-24-,38-25-,39-24-,40-25-,41-26-,42-26-
InChIKey KYZUQWPLKHFMSF-XGAKKYBISA-N
Molecular Weight 676.950 g/mol
SMILES [nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4C)CCCN2CCOCC2)c(c3CC)C)c(c1CC)C)C)CCCN1CCOCC1
SPLASH splash10-004i-0000098000-16b159a8b8d613b1029f
Source of Spectrum HC-23-184-0
Wiley ID 1414191