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5,8-bis-(4-n-butyl-phenylethynyl)-quinoline

View entire compound with spectra: 1 MS (GC)

5,8-bis-(4-n-butyl-phenylethynyl)-quinoline
SpectraBase Compound ID 54cTVW5LrsE
InChI InChI=1S/C33H31N/c1-3-5-8-26-11-15-28(16-12-26)19-21-30-23-24-31(33-32(30)10-7-25-34-33)22-20-29-17-13-27(14-18-29)9-6-4-2/h7,10-18,23-25H,3-6,8-9H2,1-2H3
InChIKey ZWOHSLRNHGGGCY-UHFFFAOYSA-N
Mol Weight 441.6 g/mol
Molecular Formula C33H31N
Exact Mass 441.24565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BN0Or79S6sk
Name 5,8-bis-(4-n-butyl-phenylethynyl)-quinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H31N
InChI InChI=1S/C33H31N/c1-3-5-8-26-11-15-28(16-12-26)19-21-30-23-24-31(33-32(30)10-7-25-34-33)22-20-29-17-13-27(14-18-29)9-6-4-2/h7,10-18,23-25H,3-6,8-9H2,1-2H3
InChIKey ZWOHSLRNHGGGCY-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 441.618 g/mol
SMILES c1nc2c(ccc(c2cc1)C#Cc1ccc(cc1)CCCC)C#Cc1ccc(cc1)CCCC
SPLASH splash10-0006-0105900000-2b8f3efdd43180db4553
Source of Spectrum DE102012004393A1
Wiley ID 1852173