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2,2-Dimethyl-4-(2'-methylprop-1'-enyl)thiethan-3-one
SpectraBase Compound ID EvYOA1icIsM
InChI InChI=1S/C9H14OS/c1-6(2)7-5-11-9(3,4)8(7)10/h7H,1,5H2,2-4H3
InChIKey WCZYVOGBSOFXLU-UHFFFAOYSA-N
Mol Weight 170.27 g/mol
Molecular Formula C9H14OS
Exact Mass 170.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8hLHgWlpAJd
Name 2,2-Dimethyl-4-(2'-methylprop-1'-enyl)thiethan-3-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14OS
InChI InChI=1S/C9H14OS/c1-6(2)7-5-11-9(3,4)8(7)10/h7H,1,5H2,2-4H3
InChIKey WCZYVOGBSOFXLU-UHFFFAOYSA-N
Molecular Weight 170.270 g/mol
SMILES C1(C(CSC1(C)C)C(=C)C)=O
SPLASH splash10-0002-9000000000-5c9e277f646b024dc902
Source of Spectrum H-75-2269-13
Synonyms 4-isopropenyl-2,2-dimethyldihydro-3(2H)-thiophenone
Wiley ID 1166494