N-(1,3-Benzodioxol-5-yl)-2-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazino}acetamide

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Systematic / IUPAC Name: N-(1,3-Benzodioxol-5-yl)-2-{4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl}acetamide

ID: Reference3945

Other Names: N-(2H-1,3-Benzodioxol-5-yl)-2-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}acetamide

Formula: C19H19F3N4O3

Spectral Data

N-(1,3-Benzodioxol-5-yl)-2-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazino}acetamide 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 2
No. of Spectra 237
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/24/2016 10:31:24 AM
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Identificators

InChI InChI=1S/C19H19F3N4O3/c20-19(21,22)13-1-4-17(23-10-13)26-7-5-25(6-8-26)11-18(27)24-14-2-3-15-16(9-14)29-12-28-15/h1-4,9-10H,5-8,11-12H2,(H,24,27)
InChI Key CTDLGEVBOYEYJE-UHFFFAOYSA-N
Canonical SMILES C1CN(CCN1CC(=O)NC2=CC3=C(C=C2)OCO3)C4=NC=C(C=C4)C(F)(F)F
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Other Names N-(2H-1,3-Benzodioxol-5-yl)-2-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}acetamide

In Other Databases

ChemSpider 2087847
PubChem 2809425
ChEMBL CHEMBL1705768