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2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]acetonitrile
SpectraBase Compound ID 7O23jQNhnFj
InChI InChI=1S/C11H8ClN3/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 ZWKKHRLWUFOSPA-UHFFFAOYSA-N
Mol Weight 217.66 g/mol
Molecular Formula C11H8ClN3
Exact Mass 217.040675 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FdiUUCxJx7p
Name 2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]acetonitrile
Alternate Name(s) 2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]ethanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8ClN3
InChI InChI=1S/C11H8ClN3/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 ZWKKHRLWUFOSPA-UHFFFAOYSA-N
Molecular Weight 217.659 g/mol
SMILES [nH]1c(cc(n1)CC#N)-c1ccc(cc1)Cl
SPLASH splash10-014i-0290000000-fbdd1a824d1357f7fd39
Source of Spectrum Y1-36-876-18
Wiley ID 1527136