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3-Cyanomethyl-5-(4'-methoxyphenyl)pyrazole
SpectraBase Compound ID Cm2eTm3ztJP
InChI InChI=1S/C12H11N3O/c1-16-11-4-2-9(3-5-11)12-8-10(6-7-13)14-15-12/h2-5,8H,6H2,1H3,(H,14,15)
InChIKey ZVGCJBIDARLIMB-UHFFFAOYSA-N
Mol Weight 213.24 g/mol
Molecular Formula C12H11N3O
Exact Mass 213.090212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4HKXAMWjKl
Name 3-Cyanomethyl-5-(4'-methoxyphenyl)pyrazole
Alternate Name(s) [5-(4-methoxyphenyl)-1H-pyrazol-3-yl]acetonitrile 2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]ethanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3O
InChI InChI=1S/C12H11N3O/c1-16-11-4-2-9(3-5-11)12-8-10(6-7-13)14-15-12/h2-5,8H,6H2,1H3,(H,14,15)
InChIKey ZVGCJBIDARLIMB-UHFFFAOYSA-N
Molecular Weight 213.240 g/mol
SMILES [nH]1c(cc(n1)CC#N)-c1ccc(cc1)OC
SPLASH splash10-03di-0090000000-2e807ba680ad836f8a2f
Source of Spectrum Y1-36-876-21
Wiley ID 1527133