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4,7-bis-(4-n-butyl-phenylethynyl)-indane
SpectraBase Compound ID GPtEedSp5dV
InChI InChI=1S/C33H34/c1-3-5-8-26-12-16-28(17-13-26)20-22-30-24-25-31(33-11-7-10-32(30)33)23-21-29-18-14-27(15-19-29)9-6-4-2/h12-19,24-25H,3-11H2,1-2H3
InChIKey DGNREAVOIUJRQZ-UHFFFAOYSA-N
Mol Weight 430.6 g/mol
Molecular Formula C33H34
Exact Mass 430.266051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQrrgtSODUQ
Name 4,7-bis-(4-n-butyl-phenylethynyl)-indane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H34
InChI InChI=1S/C33H34/c1-3-5-8-26-12-16-28(17-13-26)20-22-30-24-25-31(33-11-7-10-32(30)33)23-21-29-18-14-27(15-19-29)9-6-4-2/h12-19,24-25H,3-11H2,1-2H3
InChIKey DGNREAVOIUJRQZ-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 430.635 g/mol
SMILES c1(ccc(C#Cc2ccc(cc2)CCCC)c2c1CCC2)C#Cc1ccc(cc1)CCCC
SPLASH splash10-001i-0102900000-fc1b31d0207e32501d21
Source of Spectrum DE102012004393A1
Wiley ID 1852172