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4-Methanesulfonyloxybenzonitrile
SpectraBase Compound ID G8y1baE3Lxc
InChI InChI=1S/C8H7NO3S/c1-13(10,11)12-8-4-2-7(6-9)3-5-8/h2-5H,1H3
InChIKey KBEOVAOGOKJRCY-UHFFFAOYSA-N
Mol Weight 197.21 g/mol
Molecular Formula C8H7NO3S
Exact Mass 197.014664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FaaFuZIe9h
Name 4-Methanesulfonyloxybenzonitrile
Alternate Name(s) Methanesulfonic acid (4-cyanophenyl) ester (4-cyanophenyl) methanesulfonate
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Formula C8H7NO3S
InChI InChI=1S/C8H7NO3S/c1-13(10,11)12-8-4-2-7(6-9)3-5-8/h2-5H,1H3
InChIKey KBEOVAOGOKJRCY-UHFFFAOYSA-N
Molecular Weight 197.208 g/mol
SMILES c1(OS(=O)(=O)C)ccc(C#N)cc1
SPLASH splash10-004j-9400000000-b5f8faacdcadbdd347bc
Source of Spectrum J-60-184-0
Wiley ID 1194253