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6-Heptyl-tetrahydropyran-2-thione
SpectraBase Compound ID I33Xu15JxO2
InChI InChI=1S/C12H22OS/c1-2-3-4-5-6-8-11-9-7-10-12(14)13-11/h11H,2-10H2,1H3
InChIKey KFLLHCHPZXFRBY-UHFFFAOYSA-N
Mol Weight 214.37 g/mol
Molecular Formula C12H22OS
Exact Mass 214.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DQas6RW5rMs
Name 6-Heptyl-tetrahydropyran-2-thione
Classification Oxanes
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 214.139136501 u
Formula C12H22OS
InChI InChI=1S/C12H22OS/c1-2-3-4-5-6-8-11-9-7-10-12(14)13-11/h11H,2-10H2,1H3
InChIKey KFLLHCHPZXFRBY-UHFFFAOYSA-N
Molecular Weight 214.367 g/mol
Number of Peaks 14
SMILES C1(CCCC(O1)CCCCCCC)=S
SPLASH splash10-05mo-9000000000-7c2273948e6597a95821
Source of Spectrum FF-21-178-11 (DOI: 10.1002/ffj.1559)
Synonyms .gamma.-thionododecalactone 6-Heptyltetrahydro-2H-pyran-2-thione 6-Heptyl-2-oxanethione 6-Heptyloxane-2-thione
Wiley ID 1775433