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(E)-1-ethynyl-2-(hex-4-en-1-ynyl)benzene
SpectraBase Compound ID 5R2fLBNinR8
InChI InChI=1S/C14H12/c1-3-5-6-7-11-14-12-9-8-10-13(14)4-2/h2-3,5,8-10,12H,6H2,1H3/b5-3+
InChIKey NCDMIJAFHGDHDE-HWKANZROSA-N
Mol Weight 180.25 g/mol
Molecular Formula C14H12
Exact Mass 180.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZJnH8BSTRP
Name (E)-1-ethynyl-2-(hex-4-en-1-ynyl)benzene
Alternate Name(s) (E)-1-ethynyl-2-(hex-4-en-1-yn-1-yl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12
InChI InChI=1S/C14H12/c1-3-5-6-7-11-14-12-9-8-10-13(14)4-2/h2-3,5,8-10,12H,6H2,1H3/b5-3+
InChIKey NCDMIJAFHGDHDE-HWKANZROSA-N
Molecular Weight 180.250 g/mol
SMILES c1cc(c(cc1)C#C)C#CC\C=C\C
SPLASH splash10-00or-0900000000-322eea6e7eefb916f074
Source of Spectrum ASC-359-225/SM31-7e
Wiley ID 1806225