| SpectraBase Compound ID | 1ieq2zawAOc |
|---|---|
| InChI | InChI=1S/C12H22N2O5/c1-7(2)10(14-12(17)19-8(3)4)11(16)13-6-9(15)18-5/h7-8,10H,6H2,1-5H3,(H,13,16)(H,14,17) |
| InChIKey | BVTCBWPZONBQBK-UHFFFAOYSA-N |
| Mol Weight | 274.32 g/mol |
| Molecular Formula | C12H22N2O5 |
| Exact Mass | 274.152872 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HRSye6ABZ0Z |
|---|---|
| Name | val-gly, N-Isopropoxycarbonyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.152871811 u |
| Formula | C12H22N2O5 |
| InChI | InChI=1S/C12H22N2O5/c1-7(2)10(14-12(17)19-8(3)4)11(16)13-6-9(15)18-5/h7-8,10H,6H2,1-5H3,(H,13,16)(H,14,17) |
| InChIKey | BVTCBWPZONBQBK-UHFFFAOYSA-N |
| Molecular Weight | 274.317 g/mol |
| SMILES | C(C(NC(OC(C)C)=O)C(C)C)(=O)NCC(=O)OC |