N-Butyl-N'-[3-(tert-butyl)-1-methyl-1H-pyrazol-5-yl]urea

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Systematic / IUPAC Name: 1-Butyl-3-[1-methyl-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]urea

ID: Reference6706

Other Names: 3-Butyl-1-(3-tert-butyl-1-methyl-1H-pyrazol-5-yl)urea;
Urea, N-butyl-N'-[3-(1,1-dimethylethyl)-1-methyl-1H-pyrazol-5-yl]-

Formula: C13H24N4O

Spectral Data

N-Butyl-N'-[3-(tert-butyl)-1-methyl-1H-pyrazol-5-yl]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 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 8/10/2017 7:33:50 AM
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Identificators

InChI InChI=1S/C13H24N4O/c1-6-7-8-14-12(18)15-11-9-10(13(2,3)4)16-17(11)5/h9H,6-8H2,1-5H3,(H2,14,15,18)
InChI Key UZYJSVVSIKOIDL-UHFFFAOYSA-N
Canonical SMILES CCCCNC(=O)NC1=CC(=NN1C)C(C)(C)C
CAS
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Other Names 3-Butyl-1-(3-tert-butyl-1-methyl-1H-pyrazol-5-yl)urea;
Urea, N-butyl-N'-[3-(1,1-dimethylethyl)-1-methyl-1H-pyrazol-5-yl]-

In Other Databases

ChemSpider 2090164
PubChem 2811754