| SpectraBase Compound ID | I39eEbYoKTw |
|---|---|
| InChI | InChI=1S/C17H24N2O3/c1-4-11-17(12-5-2)14(20)18(3)16(22)19(15(17)21)13-9-7-6-8-10-13/h4-5,13H,1-2,6-12H2,3H3 |
| InChIKey | MTOJRVSZXNBDRP-UHFFFAOYSA-N |
| Mol Weight | 304.39 g/mol |
| Molecular Formula | C17H24N2O3 |
| Exact Mass | 304.178693 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2UHm0vFNYzy |
|---|---|
| Name | 1-Cyclohexyl-5,5-diallyl-3-methylbarbituric acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.178692638 u |
| Formula | C17H24N2O3 |
| InChI | InChI=1S/C17H24N2O3/c1-4-11-17(12-5-2)14(20)18(3)16(22)19(15(17)21)13-9-7-6-8-10-13/h4-5,13H,1-2,6-12H2,3H3 |
| InChIKey | MTOJRVSZXNBDRP-UHFFFAOYSA-N |
| Molecular Weight | 304.390 g/mol |
| SMILES | C1(=O)N(C(=O)N(C(C1(CC=C)CC=C)=O)C1CCCCC1)C |