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1-Hexynyl-1,3,5,7-cyclooctatetraene

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1-Hexynyl-1,3,5,7-cyclooctatetraene
SpectraBase Compound ID 4FG4zuHCYWD
InChI InChI=1S/C14H16/c1-2-3-4-8-11-14-12-9-6-5-7-10-13-14/h5-7,9-10,12-13H,2-4H2,1H3/b6-5-,7-5-,9-6-,10-7-,12-9-,13-10-,14-12-,14-13-
InChIKey SVVFSKGNHRTKHA-LPZWHSCSSA-N
Mol Weight 184.28 g/mol
Molecular Formula C14H16
Exact Mass 184.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLyNylxHc39
Name 1-Hexynyl-1,3,5,7-cyclooctatetraene
Comments Less than 3 mono-isotopic peaks
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Formula C14H16
InChI InChI=1S/C14H16/c1-2-3-4-8-11-14-12-9-6-5-7-10-13-14/h5-7,9-10,12-13H,2-4H2,1H3/b6-5-,7-5-,9-6-,10-7-,12-9-,13-10-,14-12-,14-13-
InChIKey SVVFSKGNHRTKHA-LPZWHSCSSA-N
Molecular Weight 184.282 g/mol
SMILES C(#CCCCC)\C1=C\C=C/C=C\C=C/1
SPLASH splash10-0udi-0090000000-93accaf7e428627c4135
Source of Spectrum J-56-5141-6
Synonyms 1-hexynyl-2,4,6,8-cyclooctatetraene
Wiley ID 1181625