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Acetonitrile, 2-(5-chloro-3-oxo-3H-1,2-dithiol-4-yl)propylamino-
SpectraBase Compound ID A7NsWMZZcuz
InChI InChI=1S/C8H9ClN2OS2/c1-2-4-11(5-3-10)6-7(9)13-14-8(6)12/h2,4-5H2,1H3
InChIKey WNJBTQJHFZEARW-UHFFFAOYSA-N
Mol Weight 248.75 g/mol
Molecular Formula C8H9ClN2OS2
Exact Mass 247.984483 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sXtC7B14q8
Name Acetonitrile, 2-(5-chloro-3-oxo-3H-1,2-dithiol-4-yl)propylamino-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9ClN2OS2
InChI InChI=1S/C8H9ClN2OS2/c1-2-4-11(5-3-10)6-7(9)13-14-8(6)12/h2,4-5H2,1H3
InChIKey WNJBTQJHFZEARW-UHFFFAOYSA-N
Molecular Weight 248.746 g/mol
SMILES C1(=C(SSC1=O)Cl)N(CC#N)CCC
SPLASH splash10-03dl-9440000000-33c4eaf4e7122720a0fe
Source of Spectrum AD-0-2532-0
Synonyms 2-[(3-chloranyl-5-oxidanylidene-1,2-dithiol-4-yl)-propyl-amino]ethanenitrile 2-[(3-chloro-5-keto-dithiol-4-yl)-propyl-amino]acetonitrile 2-[(3-chloro-5-oxo-4-dithiolyl)-propylamino]acetonitrile 2-[(3-chloro-5-oxo-dithiol-4-yl)-propyl-amino]acetonitrile [(5-Chloro-3-oxo-3H-1,2-dithiol-4-yl)(propyl)amino]acetonitrile
Wiley ID 1430988