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2-(3-Chloranyl-4-oxidanyl-phenyl)sulfanylethanenitrile
SpectraBase Compound ID ACcP5o72zp
InChI InChI=1S/C8H6ClNOS/c9-7-5-6(12-4-3-10)1-2-8(7)11/h1-2,5,11H,4H2
InChIKey PLUDPLJNTJHQCY-UHFFFAOYSA-N
Mol Weight 199.65 g/mol
Molecular Formula C8H6ClNOS
Exact Mass 198.985863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCreinA8mkF
Name 2-(3-Chloranyl-4-oxidanyl-phenyl)sulfanylethanenitrile
Alternate Name(s) 2-(3-Chloro-4-hydroxy-phenyl)sulfanylacetonitrile 2-[(3-chloro-4-hydroxy-phenyl)thio]acetonitrile 2-[(3-chloro-4-hydroxyphenyl)thio]acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6ClNOS
InChI InChI=1S/C8H6ClNOS/c9-7-5-6(12-4-3-10)1-2-8(7)11/h1-2,5,11H,4H2
InChIKey PLUDPLJNTJHQCY-UHFFFAOYSA-N
Molecular Weight 199.655 g/mol
SMILES Oc1ccc(cc1Cl)SCC#N
SPLASH splash10-0bta-1910000000-93df5a9f6f469c26efaf
Source of Spectrum RB-1982-13481-0
Wiley ID 1196472