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2,7,12,18-Tetramethyl-3,8-diethyl-13,17-bis[3-N,N-bis(2-hydroxyethyl)aminopropyl]porphydrin
SpectraBase Compound ID EmpxJbeOnNb
InChI InChI=1S/C42H60N6O4/c1-7-31-27(3)35-23-36-29(5)33(11-9-13-47(15-19-49)16-20-50)41(45-36)26-42-34(12-10-14-48(17-21-51)18-22-52)30(6)38(46-42)25-40-32(8-2)28(4)37(44-40)24-39(31)43-35/h23-26,43,46,49-52H,7-22H2,1-6H3/b35-23-,36-23-,37-24-,38-25-,39-24-,40-25-,41-26-,42-26-
InChIKey YPQXTWCLBAAOEB-XGAKKYBISA-N
Mol Weight 713.0 g/mol
Molecular Formula C42H60N6O4
Exact Mass 712.467604 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7G7a5qyIgzV
Name 2,7,12,18-Tetramethyl-3,8-diethyl-13,17-bis[3-N,N-bis(2-hydroxyethyl)aminopropyl]porphydrin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H60N6O4
InChI InChI=1S/C42H60N6O4/c1-7-31-27(3)35-23-36-29(5)33(11-9-13-47(15-19-49)16-20-50)41(45-36)26-42-34(12-10-14-48(17-21-51)18-22-52)30(6)38(46-42)25-40-32(8-2)28(4)37(44-40)24-39(31)43-35/h23-26,43,46,49-52H,7-22H2,1-6H3/b35-23-,36-23-,37-24-,38-25-,39-24-,40-25-,41-26-,42-26-
InChIKey YPQXTWCLBAAOEB-XGAKKYBISA-N
Molecular Weight 712.980 g/mol
SMILES [nH]1c2c(CCCN(CCO)CCO)c(c1cc1nc(cc3c(c(c(cc4nc(c2)c(c4C)CCCN(CCO)CCO)[nH]3)C)CC)c(c1CC)C)C
SPLASH splash10-0udi-0000900000-bc2a73aeba546504426c
Source of Spectrum HC-23-183-0
Synonyms 2-[{3-[20-{3-[bis(2-hydroxyethyl)amino]propyl}-10,15-diethyl-5,9,14,19-tetramethyl-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-4-yl]propyl}(2-hydroxyethyl)amino]ethanol
Wiley ID 1415413