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9-(2'-Phenylethynyl)-triptycene
SpectraBase Compound ID 2GBoF7YxeMp
InChI InChI=1S/C28H18/c1-2-10-20(11-3-1)18-19-28-24-15-7-4-12-21(24)27(22-13-5-8-16-25(22)28)23-14-6-9-17-26(23)28/h1-17,27H
InChIKey WTHDQTUBWFGYLG-UHFFFAOYSA-N
Mol Weight 354.45 g/mol
Molecular Formula C28H18
Exact Mass 354.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ap1sXUl4VB
Name 9-(2'-Phenylethynyl)-triptycene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H18
InChI InChI=1S/C28H18/c1-2-10-20(11-3-1)18-19-28-24-15-7-4-12-21(24)27(22-13-5-8-16-25(22)28)23-14-6-9-17-26(23)28/h1-17,27H
InChIKey WTHDQTUBWFGYLG-UHFFFAOYSA-N
Molecular Weight 354.452 g/mol
SMILES C12(c3c(C(c4c2cccc4)c2c1cccc2)cccc3)C#Cc1ccccc1
SPLASH splash10-0udi-0039000000-65737456754240d09d41
Source of Spectrum C-124-4702-8
Wiley ID 1700849