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3-Chloro-5-iodoisothiazole-4-carbonitrile

View entire compound with spectra: 1 MS (GC)

3-Chloro-5-iodoisothiazole-4-carbonitrile
SpectraBase Compound ID DOCcuikBno1
InChI InChI=1S/C4ClIN2S/c5-3-2(1-7)4(6)9-8-3
InChIKey IWSYSQNDNKRMAC-UHFFFAOYSA-N
Mol Weight 270.48 g/mol
Molecular Formula C4ClIN2S
Exact Mass 269.851542 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fDfE11jDWy
Name 3-Chloro-5-iodoisothiazole-4-carbonitrile
Alternate Name(s) 3-Chloro-5-iodo-4-isothiazolecarbonitrile 3-Chloro-5-iodo-1,2-thiazole-4-carbonitrile 3-Chloranyl-5-iodanyl-1,2-thiazole-4-carbonitrile
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Formula C4ClIN2S
InChI InChI=1S/C4ClIN2S/c5-3-2(1-7)4(6)9-8-3
InChIKey IWSYSQNDNKRMAC-UHFFFAOYSA-N
Molecular Weight 270.475 g/mol
SMILES c1(c(snc1Cl)I)C#N
SPLASH splash10-00di-4290000000-6dee24364077d4790737
Source of Spectrum F5-4-3688-11
Wiley ID 1733015