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2-Benzylsulfanyl-6-fluoro-4-nitrobenzonitrile
SpectraBase Compound ID IKWpNG2nX7i
InChI InChI=1S/C14H9FN2O2S/c15-13-6-11(17(18)19)7-14(12(13)8-16)20-9-10-4-2-1-3-5-10/h1-7H,9H2
InChIKey BZCUKNXHWSLYAV-UHFFFAOYSA-N
Mol Weight 288.3 g/mol
Molecular Formula C14H9FN2O2S
Exact Mass 288.036877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6KYiOUaCaNE
Name 2-Benzylsulfanyl-6-fluoro-4-nitrobenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9FN2O2S
InChI InChI=1S/C14H9FN2O2S/c15-13-6-11(17(18)19)7-14(12(13)8-16)20-9-10-4-2-1-3-5-10/h1-7H,9H2
InChIKey BZCUKNXHWSLYAV-UHFFFAOYSA-N
Molecular Weight 288.296 g/mol
SMILES C(c1c(cc(cc1F)N(=O)=O)SCc1ccccc1)#N
SPLASH splash10-0006-9000000000-cf72efb9baf19610ca50
Source of Spectrum H1-68-1114-5
Synonyms 2-Benzylsulfanyl-6-fluoro-4-nitro-benzonitrile 2-(benzylthio)-6-fluoro-4-nitro-benzonitrile 2-Fluoranyl-4-nitro-6-(phenylmethylsulfanyl)benzenecarbonitrile 2-Fluoro-4-nitro-6-(phenylmethylthio)benzonitrile
Wiley ID 1593553