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2-Benzylsulfonyl-4,6-diphenoxybenzonitrile
SpectraBase Compound ID 9FzVz9rZTJf
InChI InChI=1S/C26H19NO4S/c27-18-24-25(31-22-14-8-3-9-15-22)16-23(30-21-12-6-2-7-13-21)17-26(24)32(28,29)19-20-10-4-1-5-11-20/h1-17H,19H2
InChIKey KRLGAXWPQGNKFX-UHFFFAOYSA-N
Mol Weight 441.5 g/mol
Molecular Formula C26H19NO4S
Exact Mass 441.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID drEvHhoceY
Name 2-Benzylsulfonyl-4,6-diphenoxybenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H19NO4S
InChI InChI=1S/C26H19NO4S/c27-18-24-25(31-22-14-8-3-9-15-22)16-23(30-21-12-6-2-7-13-21)17-26(24)32(28,29)19-20-10-4-1-5-11-20/h1-17H,19H2
InChIKey KRLGAXWPQGNKFX-UHFFFAOYSA-N
Molecular Weight 441.501 g/mol
SMILES c1ccc(Oc2c(c(S(Cc3ccccc3)(=O)=O)cc(Oc3ccccc3)c2)C#N)cc1
SPLASH splash10-0006-9212000000-f2855d1c309c53a8c44b
Synonyms 2,4-Diphenoxy-6-(phenylmethyl)sulfonyl-benzenecarbonitrile 2,4-Diphenoxy-6-(phenylmethyl)sulfonylbenzonitrile 2-Benzylsulfonyl-4,6-diphenoxy-benzonitrile
Wiley ID 1459669