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1-(3-cyclohexenylprop-1-ynyl)-2-ethynylbenzene
SpectraBase Compound ID AdMXmsUVusY
InChI InChI=1S/C17H16/c1-2-16-12-6-7-13-17(16)14-8-11-15-9-4-3-5-10-15/h1,6-7,9,12-13H,3-5,10-11H2
InChIKey FZFIOYKYRSWFPA-UHFFFAOYSA-N
Mol Weight 220.31 g/mol
Molecular Formula C17H16
Exact Mass 220.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7RQ88Nkle6b
Name 1-(3-cyclohexenylprop-1-ynyl)-2-ethynylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16
InChI InChI=1S/C17H16/c1-2-16-12-6-7-13-17(16)14-8-11-15-9-4-3-5-10-15/h1,6-7,9,12-13H,3-5,10-11H2
InChIKey FZFIOYKYRSWFPA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201600987
Molecular Weight 220.315 g/mol
SMILES c1cc(c(cc1)C#C)C#CCC=1CCCCC1
SPLASH splash10-014i-0950000000-49146fd27f9662510330
Source of Spectrum ASC-359-225/SM32-7g
Synonyms 1-(3-(cyclohex-1-en-1-yl)prop-1-yn-1-yl)-2-ethynylbenzene
Wiley ID 1806227