Ethyl 1-(2-furylcarbonyl)-3-propyl-1H-pyrazole-4-carboxylate

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Systematic / IUPAC Name: Ethyl 1-(2-furoyl)-3-propyl-1H-pyrazole-4-carboxylate

ID: Reference6972

Other Names: 1H-Pyrazole-4-carboxylic acid, 1-(2-furanylcarbonyl)-3-propyl-, ethyl ester

Formula: C14H16N2O4

Spectral Data

Ethyl 1-(2-furylcarbonyl)-3-propyl-1H-pyrazole-4-carboxylate 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/20/2017 8:54:59 AM
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Identificators

InChI InChI=1S/C14H16N2O4/c1-3-6-11-10(14(18)19-4-2)9-16(15-11)13(17)12-7-5-8-20-12/h5,7-9H,3-4,6H2,1-2H3
InChI Key KXYAGIOOVGHXDC-UHFFFAOYSA-N
Canonical SMILES CCCC1=NN(C=C1C(=O)OCC)C(=O)C2=CC=CO2
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Other Names 1H-Pyrazole-4-carboxylic acid, 1-(2-furanylcarbonyl)-3-propyl-, ethyl ester

In Other Databases

PubChem 2807780
ChemSpider 2086226