3-(4-Chloro-1-methyl-1H-pyrazol-3-yl)-2-cyanoacrylamide

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Systematic / IUPAC Name: (2E)-3-(4-Chloro-1-methyl-1H-pyrazol-3-yl)-2-cyanoacrylamide

ID: Reference3843

Other Names: 2-Propenamide, 3-(4-chloro-1-methyl-1H-pyrazol-3-yl)-2-cyano-, (2E)-

Formula: C8H7ClN4O

Spectral Data

3-(4-Chloro-1-methyl-1H-pyrazol-3-yl)-2-cyanoacrylamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 118
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/15/2016 11:23:06 AM
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Identificators

InChI InChI=1S/C8H7ClN4O/c1-13-4-6(9)7(12-13)2-5(3-10)8(11)14/h2,4H,1H3,(H2,11,14)/b5-2+
InChI Key OJTSYSZUJDWOAO-GORDUTHDSA-N
Canonical SMILES CN1C=C(C(=N1)C=C(C#N)C(=O)N)Cl
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Other Names 2-Propenamide, 3-(4-chloro-1-methyl-1H-pyrazol-3-yl)-2-cyano-, (2E)-

In Other Databases

ChemSpider 4804074
PubChem 6090012