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1-(1-Octynyl)-4-(2-phenylethynyl)benzene
SpectraBase Compound ID 8zrs705urGM
InChI InChI=1S/C22H22/c1-2-3-4-5-6-8-13-21-15-18-22(19-16-21)17-14-20-11-9-7-10-12-20/h7,9-12,15-16,18-19H,2-6H2,1H3
InChIKey WMQFQMFQBHTPFT-UHFFFAOYSA-N
Mol Weight 286.42 g/mol
Molecular Formula C22H22
Exact Mass 286.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6uJpglLodC
Name 1-(1-Octynyl)-4-(2-phenylethynyl)benzene
Appearance Off-white solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22
InChI InChI=1S/C22H22/c1-2-3-4-5-6-8-13-21-15-18-22(19-16-21)17-14-20-11-9-7-10-12-20/h7,9-12,15-16,18-19H,2-6H2,1H3
InChIKey WMQFQMFQBHTPFT-UHFFFAOYSA-N
Instrument Name Shimadzu GCMQP-1000 EX
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p009.123
Molecular Weight 286.418 g/mol
SMILES C(#Cc1ccc(cc1)C#Cc1ccccc1)CCCCCC
SPLASH splash10-001i-9000000000-3a4d40b6fd659d661170
Source of Spectrum ARK-2015-346-19
Wiley ID 1843400