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((5-[(Cyanomethyl)sulfanyl]-2-oxo-1,3-dithiol-4-yl)sulfanyl)acetonitrile
SpectraBase Compound ID DLCILunT7tj
InChI InChI=1S/C7H4N2OS4/c8-1-3-11-5-6(12-4-2-9)14-7(10)13-5/h3-4H2
InChIKey ASQVBHIJSVUJDD-UHFFFAOYSA-N
Mol Weight 260.4 g/mol
Molecular Formula C7H4N2OS4
Exact Mass 259.920647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Kx8jDG8H1O
Name ((5-[(Cyanomethyl)sulfanyl]-2-oxo-1,3-dithiol-4-yl)sulfanyl)acetonitrile
CAS Registry Number 179010-13-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4N2OS4
InChI InChI=1S/C7H4N2OS4/c8-1-3-11-5-6(12-4-2-9)14-7(10)13-5/h3-4H2
InChIKey ASQVBHIJSVUJDD-UHFFFAOYSA-N
Molecular Weight 260.362 g/mol
SMILES C1(SC(=C(S1)SCC#N)SCC#N)=O
SPLASH splash10-02vr-9720000000-5f248e41d98414c1b071
Source of Spectrum AD-0-2532-0
Synonyms 1,3-Dithiol-2-one, 4,5-bis(cyanomethylthio)- 2-[[5-(cyanomethylsulfanyl)-2-oxidanylidene-1,3-dithiol-4-yl]sulfanyl]ethanenitrile 2-[[5-(cyanomethylsulfanyl)-2-oxo-1,3-dithiol-4-yl]sulfanyl]acetonitrile 2-[[5-(cyanomethylthio)-2-keto-1,3-dithiol-4-yl]thio]acetonitrile 2-[[5-(cyanomethylthio)-2-oxo-1,3-dithiol-4-yl]thio]acetonitrile
Wiley ID 1428584