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5-Methyl-4-pentyl-1,3-oxathiol-2-one
SpectraBase Compound ID G8y41LARDew
InChI InChI=1S/C9H14O2S/c1-3-4-5-6-8-7(2)11-9(10)12-8/h3-6H2,1-2H3
InChIKey ICVBVZRVSAEIPP-UHFFFAOYSA-N
Mol Weight 186.27 g/mol
Molecular Formula C9H14O2S
Exact Mass 186.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AURmIhtGARt
Name 5-Methyl-4-pentyl-1,3-oxathiol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O2S
InChI InChI=1S/C9H14O2S/c1-3-4-5-6-8-7(2)11-9(10)12-8/h3-6H2,1-2H3
InChIKey ICVBVZRVSAEIPP-UHFFFAOYSA-N
Molecular Weight 186.269 g/mol
SMILES C1(SC(CCCCC)=C(O1)C)=O
SPLASH splash10-014i-2900000000-0e960fba4c27a0964183
Source of Spectrum H1-50-690-7
Wiley ID 816918