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2-Benzylsulfonyl-4,6-dimethoxybenzonitrile
SpectraBase Compound ID 7Ek0I5OgyBD
InChI InChI=1S/C16H15NO4S/c1-20-13-8-15(21-2)14(10-17)16(9-13)22(18,19)11-12-6-4-3-5-7-12/h3-9H,11H2,1-2H3
InChIKey IKDNLGCHWXLXIH-UHFFFAOYSA-N
Mol Weight 317.36 g/mol
Molecular Formula C16H15NO4S
Exact Mass 317.072179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DW3WIbF7HM5
Name 2-Benzylsulfonyl-4,6-dimethoxybenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO4S
InChI InChI=1S/C16H15NO4S/c1-20-13-8-15(21-2)14(10-17)16(9-13)22(18,19)11-12-6-4-3-5-7-12/h3-9H,11H2,1-2H3
InChIKey IKDNLGCHWXLXIH-UHFFFAOYSA-N
Molecular Weight 317.359 g/mol
SMILES C(c1c(cc(cc1OC)OC)S(=O)(=O)Cc1ccccc1)#N
SPLASH splash10-0006-9050000000-e32d4499c62254969d1f
Source of Spectrum H1-68-1116-10
Synonyms 2,4-Dimethoxy-6-(phenylmethyl)sulfonyl-benzenecarbonitrile 2,4-Dimethoxy-6-(phenylmethyl)sulfonylbenzonitrile
Wiley ID 1593547