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3-Sulfanylhexyl acetate
SpectraBase Compound ID LbjM7yHgT0N
InChI InChI=1S/C8H16O2S/c1-3-4-8(11)5-6-10-7(2)9/h8,11H,3-6H2,1-2H3
InChIKey JUCARGIKESIVLB-UHFFFAOYSA-N
Mol Weight 176.27 g/mol
Molecular Formula C8H16O2S
Exact Mass 176.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I79O4rKnCsU
Name 3-Sulfanylhexyl Acetate
CAS Registry Number 136954-20-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O2S
InChI InChI=1S/C8H16O2S/c1-3-4-8(11)5-6-10-7(2)9/h8,11H,3-6H2,1-2H3
InChIKey JUCARGIKESIVLB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ffj.3185
Molecular Weight 176.274 g/mol
SMILES SC(CCOC(C)=O)CCC
SPLASH splash10-05mx-9100000000-9f7c04b5472f8a4c514c
Source of Spectrum FF-29-108-108_1
Synonyms 3-Mercaptohexyl acetate 3-Sulfanylhexyl ethanoate
Wiley ID 1775689