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(3-Nitro-phenyl)-(3,5,5-trimethyl-4,5-dihydro-pyrazol-1-yl)-acetonitrile
SpectraBase Compound ID Kcm1FJk6ngF
InChI InChI=1S/C14H16N4O2/c1-10-8-14(2,3)17(16-10)13(9-15)11-5-4-6-12(7-11)18(19)20/h4-7,13H,8H2,1-3H3
InChIKey FRVKOHQIMGMBGE-UHFFFAOYSA-N
Mol Weight 272.31 g/mol
Molecular Formula C14H16N4O2
Exact Mass 272.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bo5XRLNppnV
Name (3-Nitro-phenyl)-(3,5,5-trimethyl-4,5-dihydro-pyrazol-1-yl)-acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N4O2
InChI InChI=1S/C14H16N4O2/c1-10-8-14(2,3)17(16-10)13(9-15)11-5-4-6-12(7-11)18(19)20/h4-7,13H,8H2,1-3H3
InChIKey FRVKOHQIMGMBGE-UHFFFAOYSA-N
Molecular Weight 272.308 g/mol
SMILES CC1=NN(C(C1)(C)C)C(c1cc(N(=O)=O)ccc1)C#N
SPLASH splash10-0a4m-9220000000-0fc347998488a709357c
Synonyms (3-Nitrophenyl)(3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-yl)acetonitrile 2-(3-nitrophenyl)-2-(3,5,5-trimethyl-2-pyrazolin-1-yl)acetonitrile 2-(3-nitrophenyl)-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)acetonitrile 2-(3-nitrophenyl)-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)ethanenitrile
Wiley ID 1459455