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(S)-(-)-Acetoxy-(4-trifluoromethyl-phenyl)-acetonitrile
SpectraBase Compound ID JPFjvP3oLo3
InChI InChI=1S/C11H8F3NO2/c1-7(16)17-10(6-15)8-2-4-9(5-3-8)11(12,13)14/h2-5,10H,1H3/t10-/m1/s1
InChIKey PNTSBTAVPHHZMK-SNVBAGLBSA-N
Mol Weight 243.19 g/mol
Molecular Formula C11H8F3NO2
Exact Mass 243.050713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwdYIMmSV5o
Name (S)-(-)-Acetoxy-(4-trifluoromethyl-phenyl)-acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8F3NO2
InChI InChI=1S/C11H8F3NO2/c1-7(16)17-10(6-15)8-2-4-9(5-3-8)11(12,13)14/h2-5,10H,1H3/t10-/m1/s1
InChIKey PNTSBTAVPHHZMK-SNVBAGLBSA-N
Molecular Weight 243.185 g/mol
SMILES C(c1ccc([C@@](C#N)(OC(=O)C)[H])cc1)(F)(F)F
SPLASH splash10-0f8c-5940000000-40b4809a089bb736be4f
Source of Spectrum F-66-628-2l
Synonyms [(S)-cyano-[4-(trifluoromethyl)phenyl]methyl] acetate [(S)-cyano-[4-(trifluoromethyl)phenyl]methyl] ethanoate
Wiley ID 1682845