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2,7,12,18-Tetramethyl-3,8-diethyl-13,17-bis(3-piperidinopropyl)porphyrin
SpectraBase Compound ID 6tsyfKhTFT
InChI InChI=1S/C44H60N6/c1-7-33-29(3)37-25-38-31(5)35(17-15-23-49-19-11-9-12-20-49)43(47-38)28-44-36(18-16-24-50-21-13-10-14-22-50)32(6)40(48-44)27-42-34(8-2)30(4)39(46-42)26-41(33)45-37/h25-28,45,48H,7-24H2,1-6H3/b37-25-,38-25-,39-26-,40-27-,41-26-,42-27-,43-28-,44-28-
InChIKey XCWVTCFLNUKWEW-YHSVLEDOSA-N
Mol Weight 673.0 g/mol
Molecular Formula C44H60N6
Exact Mass 672.487946 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dNRhmvzqAx
Name 2,7,12,18-Tetramethyl-3,8-diethyl-13,17-bis(3-piperidinopropyl)porphyrin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H60N6
InChI InChI=1S/C44H60N6/c1-7-33-29(3)37-25-38-31(5)35(17-15-23-49-19-11-9-12-20-49)43(47-38)28-44-36(18-16-24-50-21-13-10-14-22-50)32(6)40(48-44)27-42-34(8-2)30(4)39(46-42)26-41(33)45-37/h25-28,45,48H,7-24H2,1-6H3/b37-25-,38-25-,39-26-,40-27-,41-26-,42-27-,43-28-,44-28-
InChIKey XCWVTCFLNUKWEW-YHSVLEDOSA-N
Molecular Weight 673.006 g/mol
SMILES [nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4C)CCCN2CCCCC2)c(c3CC)C)c(c1CC)C)C)CCCN1CCCCC1
SPLASH splash10-00di-0000069000-98f3c831f06af19cbf26
Source of Spectrum HC-23-184-0
Synonyms 4,19-diethyl-5,9,15,20-tetramethyl-10,14-bis[3-(1-piperidinyl)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
Wiley ID 1414034