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(4S)-4-methyl-3-i-propylthio-2-hexanone
SpectraBase Compound ID KHqNOhpYTo2
InChI InChI=1S/C10H20OS/c1-6-8(4)10(9(5)11)12-7(2)3/h7-8,10H,6H2,1-5H3/t8-,10?/m0/s1
InChIKey ONEOZRROUBNENX-PEHGTWAWSA-N
Mol Weight 188.33 g/mol
Molecular Formula C10H20OS
Exact Mass 188.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1eGbcbCgV0E
Name (4S)-4-methyl-3-i-propylthio-2-hexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20OS
InChI InChI=1S/C10H20OS/c1-6-8(4)10(9(5)11)12-7(2)3/h7-8,10H,6H2,1-5H3/t8-,10?/m0/s1
InChIKey ONEOZRROUBNENX-PEHGTWAWSA-N
Ionization Type EI
Molecular Weight 188.329 g/mol
SMILES CC(C([C@](CC)(C)[H])SC(C)C)=O
SPLASH splash10-014m-9400000000-20c6a8c1ec5084483fae
Sample Comments Diastereomeric mixture
Source of Spectrum JP2010100569A
Wiley ID 1841947