N1-Isopropyl-5-(3-phenylisoxazol-5-yl)-1H-pyrazole-1-carboxamide
3594
Reference
N1-Isopropyl-5-(3-phenylisoxazol-5-yl)-1H-pyrazole-1-carboxamide Structure
Systematic / IUPAC Name: N-Isopropyl-5-(3-phenyl-1,2-oxazol-5-yl)-1H-pyrazole-1-carboxamide
ID: Reference3594
Other Names: 1H-Pyrazole-1-carboxamide, N-(1-methylethyl)-5-(3-phenyl-5-isoxazolyl)-
Formula: C16H16N4O2
Spectral Data
N1-Isopropyl-5-(3-phenylisoxazol-5-yl)-1H-pyrazole-1-carboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Elite; Q Exactive Orbitrap |
| No. of Spectral Trees | 2 |
| No. of Spectra | 1213 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | ESI; NSI |
| Analyzers | IT; FT |
| Last Modification | 1/14/2016 11:22:20 AM |
Identificators
| InChI | InChI=1S/C16H16N4O2/c1-11(2)18-16(21)20-14(8-9-17-20)15-10-13(19-22-15)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,18,21) |
| InChI Key | QRNLAIUHBMUYJS-UHFFFAOYSA-N |
| Canonical SMILES | CC(C)NC(=O)N1C(=CC=N1)C2=CC(=NO2)C3=CC=CC=C3 |
| CAS | |
| Splash | |
| Other Names | 1H-Pyrazole-1-carboxamide, N-(1-methylethyl)-5-(3-phenyl-5-isoxazolyl)- |