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2-Iodo-3-(4-tolyl-sulfonyl)-propionitrile
SpectraBase Compound ID Ifoc3I9oRBi
InChI InChI=1S/C10H10INO2S/c1-8-2-4-10(5-3-8)15(13,14)7-9(11)6-12/h2-5,9H,7H2,1H3
InChIKey NGIYEHFFCMTGFJ-UHFFFAOYSA-N
Mol Weight 335.16 g/mol
Molecular Formula C10H10INO2S
Exact Mass 334.947695 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZHCmHQp1Mp
Name 2-iodanyl-3-(4-methylphenyl)sulfonyl-propanenitrile
CAS Registry Number 19520-58-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10INO2S
InChI InChI=1S/C10H10INO2S/c1-8-2-4-10(5-3-8)15(13,14)7-9(11)6-12/h2-5,9H,7H2,1H3
InChIKey NGIYEHFFCMTGFJ-UHFFFAOYSA-N
Molecular Weight 335.159 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C(C#N)I
SPLASH splash10-052f-9600000000-ab00cbe0eab788021a9d
Source of Spectrum KC-1988-1031-2
Synonyms 2-iodo-3-(p-tolylsulfonyl)propanenitrile 2-iodo-3-tosyl-propionitrile
Wiley ID 1331479