N-(3,5-Dimethyl-4-isoxazolyl)-N'-{[5-methyl-2-(trifluoromethyl)-3-furyl]methyl}urea

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Systematic / IUPAC Name: 1-(3,5-Dimethyl-1,2-oxazol-4-yl)-3-{[5-methyl-2-(trifluoromethyl)-3-furyl]methyl}urea

ID: Reference3853

Other Names: N-(3,5-Dimethyl-4-isoxazolyl)-N'-{[5-methyl-2-(trifluoromethyl)-3-furyl]methyl}urea ;
Urea, N-(3,5-dimethyl-4-isoxazolyl)-N'-{[5-methyl-2-(trifluoromethyl)-3-furanyl]methyl}-

Formula: C13H14F3N3O3

Spectral Data

N-(3,5-Dimethyl-4-isoxazolyl)-N'-{[5-methyl-2-(trifluoromethyl)-3-furyl]methyl}urea 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 203
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/15/2016 2:05:40 PM
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Identificators

InChI InChI=1S/C13H14F3N3O3/c1-6-4-9(11(21-6)13(14,15)16)5-17-12(20)18-10-7(2)19-22-8(10)3/h4H,5H2,1-3H3,(H2,17,18,20)
InChI Key ZHGDCVHWCPRGGA-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=C(O1)C(F)(F)F)CNC(=O)NC2=C(ON=C2C)C
CAS
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Other Names N-(3,5-Dimethyl-4-isoxazolyl)-N'-{[5-methyl-2-(trifluoromethyl)-3-furyl]methyl}urea ;
Urea, N-(3,5-dimethyl-4-isoxazolyl)-N'-{[5-methyl-2-(trifluoromethyl)-3-furanyl]methyl}-

In Other Databases

PubChem 2738956
ChemSpider 2020581