Systematic / IUPAC Name: 1-(2-Methylcyclohexyl)-3-phenylurea
ID: Reference2245
Other Names:
Tupersan;
Trey;
Urea, 1-(2-methylcyclohexyl)-3-phenyl-;
Dupont 1318;
1-(2-Methylcycohexyl)-3-phenylurea
Formula: C14H20N2O
Class: Pesticides/Herbicides
Siduron mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
| Used Instruments | Orbitrap ID-X with ETD_Cal Gateshead ; Q Exactive Plus Orbitrap |
| No. of Spectral Trees | 2 |
| No. of Spectra | 540 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | ESI; NSI |
| Analyzers | FT |
| Last Modification | 2/11/2015 9:19:18 AM |
| InChI | InChI=1S/C14H20N2O/c1-11-7-5-6-10-13(11)16-14(17)15-12-8-3-2-4-9-12/h2-4,8-9,11,13H,5-7,10H2,1H3,(H2,15,16,17) |
| InChI Key | JXVIIQLNUPXOII-UHFFFAOYSA-N |
| Canonical SMILES | CC1CCCCC1NC(=O)NC2=CC=CC=C2 |
| CAS | 1982496 |
| Splash | |
| Other Names |
Tupersan; Trey; Urea, 1-(2-methylcyclohexyl)-3-phenyl-; Dupont 1318; 1-(2-Methylcycohexyl)-3-phenylurea; N-(2-Methylcyclohexyl)(phenylamino)carboxamide |
| KEGG | C18435 |
| ChemIDPlus | 001982496 |
| ChemSpider | 15300 |
| PubChem | 16116 |
| ChEMBL | CHEMBL1902120 |