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Dicyclooctatetraenylacetylene

View entire compound with spectra: 1 MS (GC)

Dicyclooctatetraenylacetylene
SpectraBase Compound ID JYnBqc4QLR2
InChI InChI=1S/C18H14/c1-3-7-11-17(12-8-4-1)15-16-18-13-9-5-2-6-10-14-18/h1-14H/b3-1-,4-1-,5-2-,6-2-,7-3-,8-4-,9-5-,10-6-,11-7-,12-8-,13-9-,14-10-,17-11+,17-12+,18-13+,18-14+
InChIKey APSJAERDPMIVLX-URERRHNGSA-N
Mol Weight 230.31 g/mol
Molecular Formula C18H14
Exact Mass 230.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOfSCLzqHag
Name Dicyclooctatetraenylacetylene
Alternate Name(s) (2,4,6,8-cyclooctatetraenylethynyl)-1,3,5,7-cyclooctatetraene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14
InChI InChI=1S/C18H14/c1-3-7-11-17(12-8-4-1)15-16-18-13-9-5-2-6-10-14-18/h1-14H/b3-1-,4-1-,5-2-,6-2-,7-3-,8-4-,9-5-,10-6-,11-7-,12-8-,13-9-,14-10-,17-11+,17-12+,18-13+,18-14+
InChIKey APSJAERDPMIVLX-URERRHNGSA-N
Molecular Weight 230.310 g/mol
SMILES C(#C\C1=C\C=C/C=C\C=C/1)\C=1\C=C/C=C\C=C/C/1
SPLASH splash10-0fb9-0890000000-d1e883ca803dd26185b7
Source of Spectrum C-116-7596-24
Wiley ID 1232450