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3-Bromoisothiazole-4,5-dicarbonitrile

View entire compound with spectra: 1 MS (GC)

3-Bromoisothiazole-4,5-dicarbonitrile
SpectraBase Compound ID EOPcDTE85BW
InChI InChI=1S/C5BrN3S/c6-5-3(1-7)4(2-8)10-9-5
InChIKey WBHNOEXEABWULZ-UHFFFAOYSA-N
Mol Weight 214.04 g/mol
Molecular Formula C5BrN3S
Exact Mass 212.899631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9qvC27GDW8w
Name 3-Bromoisothiazole-4,5-dicarbonitrile
Alternate Name(s) 3-Bromanyl-1,2-thiazole-4,5-dicarbonitrile 3-Bromo-1,2-thiazole-4,5-dicarbonitrile
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Formula C5BrN3S
InChI InChI=1S/C5BrN3S/c6-5-3(1-7)4(2-8)10-9-5
InChIKey WBHNOEXEABWULZ-UHFFFAOYSA-N
Molecular Weight 214.040 g/mol
SMILES c1(nsc(c1C#N)C#N)Br
SPLASH splash10-02t9-2390000000-9b714e0894025d385c9e
Source of Spectrum K-2002-1241-12
Wiley ID 1581176