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Ethyl (E)-N-(4-cyano-1H-pyrazol-3-yl)acetimidate
SpectraBase Compound ID DGDmpawybRi
InChI InChI=1S/C8H10N4O/c1-3-13-6(2)11-8-7(4-9)5-10-12-8/h5H,3H2,1-2H3,(H,10,12)/b11-6+
InChIKey ZOEUWDSTFSFGAM-IZZDOVSWSA-N
Mol Weight 178.19 g/mol
Molecular Formula C8H10N4O
Exact Mass 178.085461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iaib3Mu00Bx
Name Ethyl (E)-N-(4-cyano-1H-pyrazol-3-yl)acetimidate
Appearance Yellow oil
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10N4O
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C8H10N4O/c1-3-13-6(2)11-8-7(4-9)5-10-12-8/h5H,3H2,1-2H3,(H,10,12)/b11-6+
InChIKey ZOEUWDSTFSFGAM-IZZDOVSWSA-N
Instrument Name Agilent 6890N-Agilent 5973
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.202102840
Quality 179
SMILES N1C=C(C(=N1)\N=C/(OCC)C)C#N
SPLASH splash10-052r-0900000000-2a51cdccd6779a007962
Source of Spectrum QE-27-SM15-2s (DOI: 10.1002/chem.202102840)
Thin-Layer Chromatography 0.65 (EtOAc)
Wiley ID 1904236