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8-Methylthiooctanenitrile
SpectraBase Compound ID AIvksSXVAi5
InChI InChI=1S/C9H17NS/c1-11-9-7-5-3-2-4-6-8-10/h2-7,9H2,1H3
InChIKey BWZCPICNIWWLFX-UHFFFAOYSA-N
Mol Weight 171.3 g/mol
Molecular Formula C9H17NS
Exact Mass 171.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2x6WtyREqe
Name Octanenitrile, 8-(methylthio)-
CAS Registry Number 58214-93-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H17NS
InChI InChI=1S/C9H17NS/c1-11-9-7-5-3-2-4-6-8-10/h2-7,9H2,1H3
InChIKey BWZCPICNIWWLFX-UHFFFAOYSA-N
Molecular Weight 171.302 g/mol
SMILES C(#N)CCCCCCCSC
SPLASH splash10-03dj-9100000000-f09419108870993f64cb
Source of Spectrum W5-10974-0-0
Synonyms 8-(Methylsulfanyl)octanenitrile 8-(Methylthio)caprylonitrile 8-(Methylthio)octanenitrile
Wiley ID 1167971