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3,5-bis[2-(4-bromophenyl)ethynyl]-N,N-dihexyl-aniline
SpectraBase Compound ID 7J3PF0aDVjX
InChI InChI=1S/C34H37Br2N/c1-3-5-7-9-23-37(24-10-8-6-4-2)34-26-30(13-11-28-15-19-32(35)20-16-28)25-31(27-34)14-12-29-17-21-33(36)22-18-29/h15-22,25-27H,3-10,23-24H2,1-2H3
InChIKey GRTHQKFUTMLQSJ-UHFFFAOYSA-N
Mol Weight 619.5 g/mol
Molecular Formula C34H37Br2N
Exact Mass 617.129276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnK0TCFQEJ
Name 3,5-bis[2-(4-bromophenyl)ethynyl]-N,N-dihexyl-aniline
Alternate Name(s) [3,5-bis[2-(4-bromophenyl)ethynyl]phenyl]-dihexyl-amine
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Formula C34H37Br2N
InChI InChI=1S/C34H37Br2N/c1-3-5-7-9-23-37(24-10-8-6-4-2)34-26-30(13-11-28-15-19-32(35)20-16-28)25-31(27-34)14-12-29-17-21-33(36)22-18-29/h15-22,25-27H,3-10,23-24H2,1-2H3
InChIKey GRTHQKFUTMLQSJ-UHFFFAOYSA-N
Molecular Weight 619.485 g/mol
SMILES c1(N(CCCCCC)CCCCCC)cc(cc(c1)C#Cc1ccc(cc1)Br)C#Cc1ccc(cc1)Br
SPLASH splash10-0002-0000296000-e52ca3c898d2159d643b
Source of Spectrum ES-2005-1291-21
Wiley ID 1563342