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Octynylpropenylbenzene
SpectraBase Compound ID 88yDTnhXRvX
InChI InChI=1S/C17H22/c1-3-5-6-7-8-9-13-17-15-11-10-14-16(17)12-4-2/h4,10-12,14-15H,3,5-8H2,1-2H3/b12-4-
InChIKey MIMDGABQWCSDGV-QCDXTXTGSA-N
Mol Weight 226.36 g/mol
Molecular Formula C17H22
Exact Mass 226.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmxQFRmPn2Q
Name Octynylpropenylbenzene
Alternate Name(s) (Z)-1-(oct-1-yn-1-yl)-2-(prop-1-en-1-yl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22
InChI InChI=1S/C17H22/c1-3-5-6-7-8-9-13-17-15-11-10-14-16(17)12-4-2/h4,10-12,14-15H,3,5-8H2,1-2H3/b12-4-
InChIKey MIMDGABQWCSDGV-QCDXTXTGSA-N
Literature Reference DOI 10.1002/adsc.200800385
Molecular Weight 226.363 g/mol
SMILES c1(c(cccc1)C#CCCCCCC)\C=C/C
SPLASH splash10-05mo-1900000000-b8ddd53d2d1f47c85141
Source of Spectrum ASC-350-2059/SM9-13g
Wiley ID 1765762