For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4,4'-(Bicyclo[1.1.1]pentane-1,3-diyldiethynediyl)dibenzoic Acid

View entire compound with spectra: 1 MS (GC)

4,4'-(Bicyclo[1.1.1]pentane-1,3-diyldiethynediyl)dibenzoic Acid
SpectraBase Compound ID zmKk1ZD7CH
InChI InChI=1S/C23H16O4/c24-20(25)18-5-1-16(2-6-18)9-11-22-13-23(14-22,15-22)12-10-17-3-7-19(8-4-17)21(26)27/h1-8H,13-15H2,(H,24,25)(H,26,27)
InChIKey LCXNUSWYPYZZAW-UHFFFAOYSA-N
Mol Weight 356.38 g/mol
Molecular Formula C23H16O4
Exact Mass 356.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IY4iEh6SkzN
Name 4,4'-(Bicyclo[1.1.1]pentane-1,3-diyldiethynediyl)dibenzoic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16O4
InChI InChI=1S/C23H16O4/c24-20(25)18-5-1-16(2-6-18)9-11-22-13-23(14-22,15-22)12-10-17-3-7-19(8-4-17)21(26)27/h1-8H,13-15H2,(H,24,25)(H,26,27)
InChIKey LCXNUSWYPYZZAW-UHFFFAOYSA-N
Molecular Weight 356.377 g/mol
SMILES OC(c1ccc(C#CC23CC(C#Cc4ccc(C(=O)O)cc4)(C3)C2)cc1)=O
SPLASH splash10-0gb9-0394000000-a3b41e4af103a6a86b1d
Source of Spectrum U1-2012-4792-a
Wiley ID 1715746