| SpectraBase Compound ID | IiNedrbYV1L |
|---|---|
| InChI | InChI=1S/C8H13N3O2/c1-2-3-6-10-8(13)11-7(12)4-5-9/h2-4,6H2,1H3,(H2,10,11,12,13) |
| InChIKey | UVNKNKHHOYKYKA-UHFFFAOYSA-N |
| Mol Weight | 183.21 g/mol |
| Molecular Formula | C8H13N3O2 |
| Exact Mass | 183.100777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7yNCJCKvYuD |
|---|---|
| Name | 1-Butyl-3-(cyanoacetyl)urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.100776669 u |
| Formula | C8H13N3O2 |
| InChI | InChI=1S/C8H13N3O2/c1-2-3-6-10-8(13)11-7(12)4-5-9/h2-4,6H2,1H3,(H2,10,11,12,13) |
| InChIKey | UVNKNKHHOYKYKA-UHFFFAOYSA-N |
| Molecular Weight | 183.211 g/mol |
| SMILES | N(C(CC#N)=O)C(NCCCC)=O |