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3-Chloro-5-ethylthio-4-pyridinecarbonitrile
SpectraBase Compound ID 9tQRn4Wvlxi
InChI InChI=1S/C8H7ClN2S/c1-2-12-8-5-11-4-7(9)6(8)3-10/h4-5H,2H2,1H3
InChIKey AECBGBXZSTYUNY-UHFFFAOYSA-N
Mol Weight 198.67 g/mol
Molecular Formula C8H7ClN2S
Exact Mass 198.001847 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HtWo57ms2Q
Name 3-Chloro-5-ethylthio-4-pyridinecarbonitrile
Alternate Name(s) 3-chloro-5-(ethylsulfanyl)isonicotinonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C8H7ClN2S
InChI InChI=1S/C8H7ClN2S/c1-2-12-8-5-11-4-7(9)6(8)3-10/h4-5H,2H2,1H3
InChIKey AECBGBXZSTYUNY-UHFFFAOYSA-N
Molecular Weight 198.671 g/mol
SMILES c1c(c(c(cn1)SCC)C#N)Cl
SPLASH splash10-00di-0900000000-7f91dc7e4fe3afe96bbe
Source of Spectrum H1-43-1897-3
Wiley ID 757988