| SpectraBase Compound ID | AI2tsOyy7w |
|---|---|
| InChI | InChI=1S/C14H19NO4/c1-4-7-10-18-13(16)12(9-6-3)15-14(17)19-11-8-5-2/h12H,6,9-11H2,1-3H3,(H,15,17)/t12-/m0/s1 |
| InChIKey | IYRVKEKPXDVZMZ-LBPRGKRZSA-N |
| Mol Weight | 265.31 g/mol |
| Molecular Formula | C14H19NO4 |
| Exact Mass | 265.131408 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KzoABipcjGW |
|---|---|
| Name | L-Norvaline, N-(but-2-yn-1-yloxycarbonyl)-, but-2-yn-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.131408092 u |
| Formula | C14H19NO4 |
| InChI | InChI=1S/C14H19NO4/c1-4-7-10-18-13(16)12(9-6-3)15-14(17)19-11-8-5-2/h12H,6,9-11H2,1-3H3,(H,15,17)/t12-/m0/s1 |
| InChIKey | IYRVKEKPXDVZMZ-LBPRGKRZSA-N |
| Molecular Weight | 265.309 g/mol |
| SMILES | CCC[C@@](C(OCC#CC)=O)(NC(=O)OCC#CC)[H] |