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7-Butyloxepane-2-thione
SpectraBase Compound ID EId3fsSWnEk
InChI InChI=1S/C10H18OS/c1-2-3-6-9-7-4-5-8-10(12)11-9/h9H,2-8H2,1H3
InChIKey MCAXROCTXJWOCL-UHFFFAOYSA-N
Mol Weight 186.31 g/mol
Molecular Formula C10H18OS
Exact Mass 186.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBK9JWPrOLn
Name 7-Butyloxepane-2-thione
Classification Oxepanes
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 186.107836373 u
Formula C10H18OS
InChI InChI=1S/C10H18OS/c1-2-3-6-9-7-4-5-8-10(12)11-9/h9H,2-8H2,1H3
InChIKey MCAXROCTXJWOCL-UHFFFAOYSA-N
Molecular Weight 186.313 g/mol
Number of Peaks 14
SMILES C1(OC(CCCC1)CCCC)=S
SPLASH splash10-00ko-9100000000-fe2799a5d7126b3e0788
Source of Spectrum FF-21-178-16 (DOI: 10.1002/ffj.1559)
Synonyms Epsilon-thionodecalactone 7-Butyl-2-oxepanethione
Wiley ID 1775438