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6-methyl-3-propionylthio-2-heptanone
SpectraBase Compound ID 22Q2Qo4Tic3
InChI InChI=1S/C11H20O2S/c1-5-11(13)14-10(9(4)12)7-6-8(2)3/h8,10H,5-7H2,1-4H3
InChIKey FUNNXFUUUUJSHM-UHFFFAOYSA-N
Mol Weight 216.34 g/mol
Molecular Formula C11H20O2S
Exact Mass 216.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bm0FyTNYBfd
Name 6-methyl-3-propionylthio-2-heptanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2S
InChI InChI=1S/C11H20O2S/c1-5-11(13)14-10(9(4)12)7-6-8(2)3/h8,10H,5-7H2,1-4H3
InChIKey FUNNXFUUUUJSHM-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 216.339 g/mol
SMILES CC(C(CCC(C)C)SC(=O)CC)=O
SPLASH splash10-0a4i-9400000000-c96b87d1f9a379e8c615
Source of Spectrum JP2010100570A
Wiley ID 1841982