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Phenylsulfonyl-acetonitrile
SpectraBase Compound ID K0YsHzefhR
InChI InChI=1S/C8H7NO2S/c9-6-7-12(10,11)8-4-2-1-3-5-8/h1-5H,7H2
InChIKey ZFCFFNGBCVAUDE-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 6c5Q1LWaRKx
Name (Phenylsulfonyl)acetonitrile
CAS Registry Number 7605-28-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NO2S
InChI InChI=1S/C8H7NO2S/c9-6-7-12(10,11)8-4-2-1-3-5-8/h1-5H,7H2
InChIKey ZFCFFNGBCVAUDE-UHFFFAOYSA-N
Molecular Weight 181.209 g/mol
SMILES C(S(=O)(=O)c1ccccc1)C#N
SPLASH splash10-004l-9400000000-ad027eff84dee52735a2
Source of Spectrum JX-2012-871
Synonyms 2-(Phenylsulfonyl)acetonitrile 2-(Benzenesulfonyl)acetonitrile 2-(Phenylsulfonyl)ethanenitrile 2-Besylacetonitrile Acetonitrile, (phenylsulfonyl)- Acetonitrile, 2-phenylsulfonyl- Benzenesulfonyl-acetonitrile Phenylsulphonylacetonitrile AI3-16855 EINECS 231-515-0
Wiley ID 1661317