![2-[(Cyclohexylcarbamoyl)amino]acetic acid, N,N-dimethyl-, methyl ester](/api/spectrum/BkynSOBaCfr/structure.png?h=300&w=458 "2-[(Cyclohexylcarbamoyl)amino]acetic acid, N,N-dimethyl-, methyl ester")
| SpectraBase Compound ID | 517Os6BmMLh |
|---|---|
| InChI | InChI=1S/C12H22N2O3/c1-13(9-11(15)17-3)12(16)14(2)10-7-5-4-6-8-10/h10H,4-9H2,1-3H3 |
| InChIKey | RQRVTHBBCPCRFP-UHFFFAOYSA-N |
| Mol Weight | 242.32 g/mol |
| Molecular Formula | C12H22N2O3 |
| Exact Mass | 242.163043 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BkynSOBaCfr |
|---|---|
| Name | 2-[(Cyclohexylcarbamoyl)amino]acetic acid, N,N-dimethyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.163042573 u |
| Formula | C12H22N2O3 |
| InChI | InChI=1S/C12H22N2O3/c1-13(9-11(15)17-3)12(16)14(2)10-7-5-4-6-8-10/h10H,4-9H2,1-3H3 |
| InChIKey | RQRVTHBBCPCRFP-UHFFFAOYSA-N |
| Molecular Weight | 242.319 g/mol |
| SMILES | C1(N(C(=O)N(CC(=O)OC)C)C)CCCCC1 |