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2,7,12,18-Tetramethyl-3,8-diethyl-13,17-bis(3-bromopropyl)porphyrin
SpectraBase Compound ID 191us7IpbSy
InChI InChI=1S/C34H40Br2N4/c1-7-23-19(3)27-15-31-24(8-2)20(4)28(38-31)17-33-26(12-10-14-36)22(6)30(40-33)18-34-25(11-9-13-35)21(5)29(39-34)16-32(23)37-27/h15-18,38-39H,7-14H2,1-6H3/b27-15-,28-17-,29-16-,30-18-,31-15-,32-16-,33-17-,34-18-
InChIKey GUYCMBSZTSNAAX-MYCJGTTRSA-N
Mol Weight 664.5 g/mol
Molecular Formula C34H40Br2N4
Exact Mass 662.161973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsTDy1GYrMk
Name 2,7,12,18-Tetramethyl-3,8-diethyl-13,17-bis(3-bromopropyl)porphyrin
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Formula C34H40Br2N4
InChI InChI=1S/C34H40Br2N4/c1-7-23-19(3)27-15-31-24(8-2)20(4)28(38-31)17-33-26(12-10-14-36)22(6)30(40-33)18-34-25(11-9-13-35)21(5)29(39-34)16-32(23)37-27/h15-18,38-39H,7-14H2,1-6H3/b27-15-,28-17-,29-16-,30-18-,31-15-,32-16-,33-17-,34-18-
InChIKey GUYCMBSZTSNAAX-MYCJGTTRSA-N
Molecular Weight 664.530 g/mol
SMILES [nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4C)CC)c(c3C)CC)c(c1C)CCCBr)CCCBr)C
SPLASH splash10-0udi-0000290000-b51def73c40033139519
Source of Spectrum HC-23-182-0
Synonyms 9,14-bis(3-bromopropyl)-4,19-diethyl-5,10,15,20-tetramethyl-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 1413640