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3-Cyanomethyl-5-(4'-fluorophenyl)pyrazole
SpectraBase Compound ID BQHQ7ixWcvQ
InChI InChI=1S/C11H8FN3/c12-9-3-1-8(2-4-9)11-7-10(5-6-13)14-15-11/h1-4,7H,5H2,(H,14,15)
InChIKey YUEINQRCAODONE-UHFFFAOYSA-N
Mol Weight 201.2 g/mol
Molecular Formula C11H8FN3
Exact Mass 201.070225 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gbjiw8CqCHj
Name 3-Cyanomethyl-5-(4'-fluorophenyl)pyrazole
Alternate Name(s) [5-(4-Fluorophenyl)-1H-pyrazol-3-yl]acetonitrile 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]ethanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8FN3
InChI InChI=1S/C11H8FN3/c12-9-3-1-8(2-4-9)11-7-10(5-6-13)14-15-11/h1-4,7H,5H2,(H,14,15)
InChIKey YUEINQRCAODONE-UHFFFAOYSA-N
Molecular Weight 201.204 g/mol
SMILES [nH]1c(cc(n1)CC#N)-c1ccc(cc1)F
SPLASH splash10-0imi-9030000000-3b91faa0e81761569ba8
Source of Spectrum Y1-32-927-5
Wiley ID 1526182