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1,2-Bisbutyl-4-ethynyl-5-iodobenzene
SpectraBase Compound ID 9qs8FUuZjIP
InChI InChI=1S/C16H21I/c1-4-7-9-14-11-13(6-3)16(17)12-15(14)10-8-5-2/h3,11-12H,4-5,7-10H2,1-2H3
InChIKey IFKWOTIWGLSPBH-UHFFFAOYSA-N
Mol Weight 340.25 g/mol
Molecular Formula C16H21I
Exact Mass 340.068796 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7FKwPdhX7FW
Name 1,2-Bisbutyl-4-ethynyl-5-iodobenzene
Alternate Name(s) 1,2-Dibutyl-4-ethynyl-5-iodobenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21I
InChI InChI=1S/C16H21I/c1-4-7-9-14-11-13(6-3)16(17)12-15(14)10-8-5-2/h3,11-12H,4-5,7-10H2,1-2H3
InChIKey IFKWOTIWGLSPBH-UHFFFAOYSA-N
Molecular Weight 340.248 g/mol
SMILES c1(c(cc(c(c1)I)C#C)CCCC)CCCC
SPLASH splash10-0a4l-0198000000-8c7bcd900dac25219d3a
Source of Spectrum CV-2004-1529-3
Wiley ID 1611561