| SpectraBase Compound ID | FWL8oPPC3jb |
|---|---|
| InChI | InChI=1S/C8H15N3O2/c1-6(2)5-10-8(13)11-4-3-9-7(11)12/h6H,3-5H2,1-2H3,(H,9,12)(H,10,13) |
| InChIKey | SBYAVOHNDJTVPA-UHFFFAOYSA-N |
| Mol Weight | 185.23 g/mol |
| Molecular Formula | C8H15N3O2 |
| Exact Mass | 185.116427 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BMLiP0NHqjQ |
|---|---|
| Name | Isocarbamid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 185.116426733 u |
| Formula | C8H15N3O2 |
| InChI | InChI=1S/C8H15N3O2/c1-6(2)5-10-8(13)11-4-3-9-7(11)12/h6H,3-5H2,1-2H3,(H,9,12)(H,10,13) |
| InChIKey | SBYAVOHNDJTVPA-UHFFFAOYSA-N |
| Molecular Weight | 185.227 g/mol |
| SMILES | CC(C)CNC(=O)N1C(=O)NCC1 |