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1-Butyl-1-(1-hexynyl)-3,5-dimethylbenzene
SpectraBase Compound ID 5EzZsBr5tZa
InChI InChI=1S/C18H26/c1-5-7-9-10-11-17-14-15(3)13-16(4)18(17)12-8-6-2/h13-14H,5-9,12H2,1-4H3
InChIKey LMAGBWMUARWCCF-UHFFFAOYSA-N
Mol Weight 242.41 g/mol
Molecular Formula C18H26
Exact Mass 242.203451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3idg22mRe9N
Name 1-Butyl-1-(1-hexynyl)-3,5-dimethylbenzene
Alternate Name(s) 2-Butyl-1-(1-hexynyl)-3,5-dimethylbenzene 2-Butyl-1-hex-1-ynyl-3,5-dimethylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26
InChI InChI=1S/C18H26/c1-5-7-9-10-11-17-14-15(3)13-16(4)18(17)12-8-6-2/h13-14H,5-9,12H2,1-4H3
InChIKey LMAGBWMUARWCCF-UHFFFAOYSA-N
Molecular Weight 242.406 g/mol
SMILES c1(C#CCCCC)c(c(C)cc(c1)C)CCCC
SPLASH splash10-052g-0930000000-ccc8d4717b7c973de86f
Source of Spectrum SO-0-690-6
Wiley ID 865194