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1,4-bis(2'-Ethylhexyloxy)-2,5-bis[(triphenylphosphonio)methyl]benzene - dibromide
SpectraBase Compound ID 4bbWWwn8Wf8
InChI InChI=1S/C60H70O2P2.2BrH/c1-5-9-29-49(7-3)45-61-59-43-52(48-64(56-37-23-14-24-38-56,57-39-25-15-26-40-57)58-41-27-16-28-42-58)60(62-46-50(8-4)30-10-6-2)44-51(59)47-63(53-31-17-11-18-32-53,54-33-19-12-20-34-54)55-35-21-13-22-36-55;;/h11-28,31-44,49-50H,5-10,29-30,45-48H2,1-4H3;2*1H/q+2;;
InChIKey HSXQJFVFCKNPCZ-UHFFFAOYSA-N
Mol Weight 1046.99 g/mol
Molecular Formula C60H72Br2O2P2
Exact Mass 1044.337432 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dlie3Fq8pf6
Name 1,4-bis(2'-Ethylhexyloxy)-2,5-bis[(triphenylphosphonio)methyl]benzene - dibromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C60H72Br2O2P2
InChI InChI=1S/C60H70O2P2.2BrH/c1-5-9-29-49(7-3)45-61-59-43-52(48-64(56-37-23-14-24-38-56,57-39-25-15-26-40-57)58-41-27-16-28-42-58)60(62-46-50(8-4)30-10-6-2)44-51(59)47-63(53-31-17-11-18-32-53,54-33-19-12-20-34-54)55-35-21-13-22-36-55;;/h11-28,31-44,49-50H,5-10,29-30,45-48H2,1-4H3;2*1H/q+2;;
InChIKey HSXQJFVFCKNPCZ-UHFFFAOYSA-N
Molecular Weight 1046.990 g/mol
SMILES Br.C([P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1c(cc(c(c1)OCC(CC)CCCC)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)OCC(CC)CCCC.Br
SPLASH splash10-00lr-3000000091-2db29a81c8bc63bd4436
Source of Spectrum B-55-503-11
Synonyms ({2,5-bis[(2-ethylhexyl)oxy]-4-[(triphenylphosphaniumyl)methyl]phenyl}methyl)triphenylphosphanium dihydrobromide
Wiley ID 1517062