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[(4-Bromophenyl)sulfonyl]acetonitrile

View entire compound with spectra: 1 MS (GC)

[(4-Bromophenyl)sulfonyl]acetonitrile
SpectraBase Compound ID 4us8TdcEirQ
InChI InChI=1S/C8H6BrNO2S/c9-7-1-3-8(4-2-7)13(11,12)6-5-10/h1-4H,6H2
InChIKey KSKSEVVFIOHIAT-UHFFFAOYSA-N
Mol Weight 260.1 g/mol
Molecular Formula C8H6BrNO2S
Exact Mass 258.930263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ye9gQerS4
Name [(4-Bromophenyl)sulfonyl]acetonitrile
Alternate Name(s) 2-(4-Bromophenyl)sulfonylacetonitrile 2-(4-Bromophenyl)sulfonylethanenitrile 2-Brosylacetonitrile Acetonitrile, 2-(4-bromophenylsulfonyl)-
CAS Registry Number 126891-45-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6BrNO2S
InChI InChI=1S/C8H6BrNO2S/c9-7-1-3-8(4-2-7)13(11,12)6-5-10/h1-4H,6H2
InChIKey KSKSEVVFIOHIAT-UHFFFAOYSA-N
Molecular Weight 260.105 g/mol
SMILES c1c(Br)ccc(S(CC#N)(=O)=O)c1
SPLASH splash10-0avi-5690000000-b9bc21d6ce8ec443a1b8
Source of Spectrum AD-0-2532-0
Wiley ID 1428597