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5-Chloro-2-(cyanothioformamido)benzonitrile
SpectraBase Compound ID 5pAy2F1pWks
InChI InChI=1S/C9H4ClN3S/c10-7-1-2-8(6(3-7)4-11)13-9(14)5-12/h1-3H,(H,13,14)
InChIKey WGYIXNFKQPMQOT-UHFFFAOYSA-N
Mol Weight 221.66 g/mol
Molecular Formula C9H4ClN3S
Exact Mass 220.981446 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BN9bisZa114
Name 5-Chloro-2-(cyanothioformamido)benzonitrile
Alternate Name(s) N-(4-chloro-2-cyanophenyl)-1-cyanomethanethioamide N-(4-chloranyl-2-cyano-phenyl)-1-cyano-methanethioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H4ClN3S
InChI InChI=1S/C9H4ClN3S/c10-7-1-2-8(6(3-7)4-11)13-9(14)5-12/h1-3H,(H,13,14)
InChIKey WGYIXNFKQPMQOT-UHFFFAOYSA-N
Molecular Weight 221.665 g/mol
SMILES N(C(C#N)=S)c1c(C#N)cc(cc1)Cl
SPLASH splash10-00du-3930000000-8dcf19ad7e8a0125c9fd
Source of Spectrum F4-41-4172-2e
Wiley ID 1673251