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1,1-di(butylthio)-4-hydroxybutan-2-one
SpectraBase Compound ID 7a7hG593bQB
InChI InChI=1S/C12H24O2S2/c1-3-5-9-15-12(11(14)7-8-13)16-10-6-4-2/h12-13H,3-10H2,1-2H3
InChIKey AOLMKCGLHAHLNH-UHFFFAOYSA-N
Mol Weight 264.44 g/mol
Molecular Formula C12H24O2S2
Exact Mass 264.121772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9OUFAsnEJlX
Name 1,1-di(butylthio)-4-hydroxybutan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O2S2
InChI InChI=1S/C12H24O2S2/c1-3-5-9-15-12(11(14)7-8-13)16-10-6-4-2/h12-13H,3-10H2,1-2H3
InChIKey AOLMKCGLHAHLNH-UHFFFAOYSA-N
Instrument Name Agilent 6890 GC-5973 N MSD
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202101730
Molecular Weight 264.442 g/mol
SMILES OCCC(C(SCCCC)SCCCC)=O
SPLASH splash10-0006-4900000000-ae8fa7d54a2b292a967c
Source of Spectrum CCC-14-SM10-DBTA-DBTHBK
Wiley ID 1871800