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3-Chloroisothiazole-4,5-dicarbonitrile

View entire compound with spectra: 1 MS (GC)

3-Chloroisothiazole-4,5-dicarbonitrile
SpectraBase Compound ID 3QKBoSkEUqI
InChI InChI=1S/C5ClN3S/c6-5-3(1-7)4(2-8)10-9-5
InChIKey KPNWYZGHGULBQP-UHFFFAOYSA-N
Mol Weight 169.59 g/mol
Molecular Formula C5ClN3S
Exact Mass 168.950146 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AGFzJ7cZ6XU
Name 3-Chloroisothiazole-4,5-dicarbonitrile
Alternate Name(s) 3-Chloranyl-1,2-thiazole-4,5-dicarbonitrile 3-Chloro-1,2-thiazole-4,5-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5ClN3S
InChI InChI=1S/C5ClN3S/c6-5-3(1-7)4(2-8)10-9-5
InChIKey KPNWYZGHGULBQP-UHFFFAOYSA-N
Molecular Weight 169.589 g/mol
SMILES c1(c(snc1Cl)C#N)C#N
SPLASH splash10-01b9-3900000000-7df70cb2577bcc0c54af
Source of Spectrum KC-0-3349-20
Wiley ID 823792