N-[1-(2-Chloro-6-fluorobenzyl)-4-piperidinyl]-5-methyl-3-isoxazolecarboxamide

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Systematic / IUPAC Name: N-[1-(2-Chloro-6-fluorobenzyl)-4-piperidinyl]-5-methyl-1,2-oxazole-3-carboxamide

ID: Reference5653

Other Names: N-{1-[(2-Chloro-6-fluorophenyl)methyl]piperidin-4-yl}-5-methyl-1,2-oxazole-3-carboxamide;
3-Isoxazolecarboxamide, N-{1-[(2-chloro-6-fluorophenyl)methyl]-4-piperidinyl}-5-methyl-

Formula: C17H19ClFN3O2

Spectral Data

N-[1-(2-Chloro-6-fluorobenzyl)-4-piperidinyl]-5-methyl-3-isoxazolecarboxamide 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 116
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 9/20/2016 10:04:41 AM
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Identificators

InChI InChI=1S/C17H19ClFN3O2/c1-11-9-16(21-24-11)17(23)20-12-5-7-22(8-6-12)10-13-14(18)3-2-4-15(13)19/h2-4,9,12H,5-8,10H2,1H3,(H,20,23)
InChI Key ORYYKLFIHVCMDF-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=NO1)C(=O)NC2CCN(CC2)CC3=C(C=CC=C3Cl)F
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Other Names N-{1-[(2-Chloro-6-fluorophenyl)methyl]piperidin-4-yl}-5-methyl-1,2-oxazole-3-carboxamide;
3-Isoxazolecarboxamide, N-{1-[(2-chloro-6-fluorophenyl)methyl]-4-piperidinyl}-5-methyl-

In Other Databases

PubChem 2810687
ChemSpider 2089102