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p-Toluenesulfonyl cyanide
SpectraBase Compound ID K2sTIKcFrfL
InChI InChI=1S/C8H7NO2S/c1-7-2-4-8(5-3-7)12(10,11)6-9/h2-5H,1H3
InChIKey JONIMGVUGJVFQD-UHFFFAOYSA-N
Mol Weight 181.21 g/mol
Molecular Formula C8H7NO2S
Exact Mass 181.01975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mrwYDDM2O6
Name p-Toluenesulfonyl cyanide
Alternate Name(s) 4-Methylbenzenesulfonyl cyanide (4-Methylphenyl)sulfonylformonitrile (4-Methylphenyl)sulfonylmethanenitrile Benzenesulfonyl cyanide, 4-methyl- p-Toluenesulphonyl cyanide p-Tolylsulfonyl cyanide p-Tolylsulfonylformonitrile Tosyl cyanide Tosylformonitrile EINECS 242-849-1
CAS Registry Number 19158-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NO2S
InChI InChI=1S/C8H7NO2S/c1-7-2-4-8(5-3-7)12(10,11)6-9/h2-5H,1H3
InChIKey JONIMGVUGJVFQD-UHFFFAOYSA-N
Molecular Weight 181.209 g/mol
SMILES C(#N)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0006-9300000000-63c26ebba3f31a02d5b2
Source of Spectrum W6-1988-13853-0
Wiley ID 134261