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4-Methoxy-2-phenylmethanesulfonyl-benzonitrile

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4-Methoxy-2-phenylmethanesulfonyl-benzonitrile
SpectraBase Compound ID L7dqtirsKs7
InChI InChI=1S/C15H13NO3S/c1-19-14-8-7-13(10-16)15(9-14)20(17,18)11-12-5-3-2-4-6-12/h2-9H,11H2,1H3
InChIKey RXMKQJVBIFCLTJ-UHFFFAOYSA-N
Mol Weight 287.33 g/mol
Molecular Formula C15H13NO3S
Exact Mass 287.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmPoQTR8FCf
Name 4-Methoxy-2-phenylmethanesulfonyl-benzonitrile
Alternate Name(s) 2-Benzylsulfonyl-4-methoxy-benzonitrile 4-Methoxy-2-(phenylmethyl)sulfonyl-benzenecarbonitrile 4-Methoxy-2-(phenylmethyl)sulfonylbenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NO3S
InChI InChI=1S/C15H13NO3S/c1-19-14-8-7-13(10-16)15(9-14)20(17,18)11-12-5-3-2-4-6-12/h2-9H,11H2,1H3
InChIKey RXMKQJVBIFCLTJ-UHFFFAOYSA-N
Molecular Weight 287.333 g/mol
SMILES c1ccc(CS(c2c(C#N)ccc(c2)OC)(=O)=O)cc1
SPLASH splash10-0006-9100000000-a3bce3f715a3e35a97e6
Wiley ID 1458515