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4-Cyanobenzothioamide
SpectraBase Compound ID 8Mla25dxQ2Z
InChI InChI=1S/C8H6N2S/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H2,10,11)
InChIKey FVLBKOUQOKBIPC-UHFFFAOYSA-N
Mol Weight 162.21 g/mol
Molecular Formula C8H6N2S
Exact Mass 162.025169 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXnbtLYf65v
Name 4-Cyanobenzothioamide
Alternate Name(s) 4-Cyanobenzenecarbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N2S
InChI InChI=1S/C8H6N2S/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H2,10,11)
InChIKey FVLBKOUQOKBIPC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.201090325
Molecular Weight 162.210 g/mol
SMILES NC(c1ccc(cc1)C#N)=S
SPLASH splash10-03e0-3900000000-a55749df90ce60488538
Source of Spectrum CJC-28-1955-23
Wiley ID 1772362