| SpectraBase Compound ID | Iv3rMXdQiil |
|---|---|
| InChI | InChI=1S/C17H32N2O5/c1-9-23-16(21)14(12(5)6)18(7)15(20)13(11(3)4)19(8)17(22)24-10-2/h11-14H,9-10H2,1-8H3 |
| InChIKey | BMPLIDJJGXPIDG-UHFFFAOYSA-N |
| Mol Weight | 344.5 g/mol |
| Molecular Formula | C17H32N2O5 |
| Exact Mass | 344.231122 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | E9Li2KwQBvM |
|---|---|
| Name | Valylvaline, N,N'-dimethyl-N'-ethoxycarbonyl-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 344.231122133 u |
| Formula | C17H32N2O5 |
| InChI | InChI=1S/C17H32N2O5/c1-9-23-16(21)14(12(5)6)18(7)15(20)13(11(3)4)19(8)17(22)24-10-2/h11-14H,9-10H2,1-8H3 |
| InChIKey | BMPLIDJJGXPIDG-UHFFFAOYSA-N |
| Molecular Weight | 344.452 g/mol |
| SMILES | CCOC(N(C)C(C(C)C)C(N(C(C(OCC)=O)C(C)C)C)=O)=O |