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2-(2-Bromo-4-phenylbut-1-en-3-ynyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
SpectraBase Compound ID 1gRvYK2K9Vo
InChI InChI=1S/C21H15Br/c22-21(14-13-17-7-2-1-3-8-17)16-20-12-6-10-18-9-4-5-11-19(20)15-18/h1-12,16H,15H2/b21-16-
InChIKey PZIJOFMVOIKVIM-PGMHBOJBSA-N
Mol Weight 347.26 g/mol
Molecular Formula C21H15Br
Exact Mass 346.035713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6DDmoHgy0xF
Name 2-(2-Bromo-4-phenylbut-1-en-3-ynyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
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Formula C21H15Br
InChI InChI=1S/C21H15Br/c22-21(14-13-17-7-2-1-3-8-17)16-20-12-6-10-18-9-4-5-11-19(20)15-18/h1-12,16H,15H2/b21-16-
InChIKey PZIJOFMVOIKVIM-PGMHBOJBSA-N
Molecular Weight 347.255 g/mol
SMILES C12=C(C=CC=C(C=CC=C2)C1)\C=C\(C#Cc1ccccc1)Br
SPLASH splash10-014i-0092000000-13e29877d021dfcbefd5
Source of Spectrum SO-0-1508-4
Synonyms 2-[(1Z)-2-bromo-4-phenyl-1-buten-3-ynyl]bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
Wiley ID 1546102