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[(1'-Methylnon-2'-ynyl)thio]benzene
SpectraBase Compound ID 1MwBmrQ7Hc7
InChI InChI=1S/C16H22S/c1-3-4-5-6-7-9-12-15(2)17-16-13-10-8-11-14-16/h8,10-11,13-15H,3-7H2,1-2H3
InChIKey YYQHRUHQTCKCFD-UHFFFAOYSA-N
Mol Weight 246.41 g/mol
Molecular Formula C16H22S
Exact Mass 246.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20LdTUPy6Vr
Name [(1'-Methylnon-2'-ynyl)thio]benzene
Alternate Name(s) 1-Methyl-2-nonynyl phenyl sulfide [(1-methyl-2-nonynyl)sulfanyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22S
InChI InChI=1S/C16H22S/c1-3-4-5-6-7-9-12-15(2)17-16-13-10-8-11-14-16/h8,10-11,13-15H,3-7H2,1-2H3
InChIKey YYQHRUHQTCKCFD-UHFFFAOYSA-N
Molecular Weight 246.412 g/mol
SMILES C(#CCCCCCC)C(Sc1ccccc1)C
SPLASH splash10-08fs-0940000000-a1bec755fa999d4011cc
Source of Spectrum AC-1992-449-6
Wiley ID 747976