(2,5-Dimethyl-3-furyl){4-[5-(trifluoromethyl)-2-pyridinyl]piperazino}methanone

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Systematic / IUPAC Name: (2,5-Dimethyl-3-furyl){4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl}methanone

ID: Reference4457

Other Names: 1-[(2,5-Dimethylfuran-3-yl)carbonyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine;
Methanone, (2,5-dimethyl-3-furanyl){4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl}-

Formula: C17H18F3N3O2

Spectral Data

(2,5-Dimethyl-3-furyl){4-[5-(trifluoromethyl)-2-pyridinyl]piperazino}methanone 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 4/7/2016 1:34:21 PM
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Identificators

InChI InChI=1S/C17H18F3N3O2/c1-11-9-14(12(2)25-11)16(24)23-7-5-22(6-8-23)15-4-3-13(10-21-15)17(18,19)20/h3-4,9-10H,5-8H2,1-2H3
InChI Key KDJLOANEMKJNKP-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=C(O1)C)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F
CAS
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Other Names 1-[(2,5-Dimethylfuran-3-yl)carbonyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine;
Methanone, (2,5-dimethyl-3-furanyl){4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl}-

In Other Databases

ChemSpider 2090142
ChEMBL CHEMBL1599326
PubChem 2811732