| SpectraBase Compound ID | 726V0VP1IsD |
|---|---|
| InChI | InChI=1S/C13H21NO4/c1-4-6-7-8-10-17-12(15)11(3)14-13(16)18-9-5-2/h2,11H,4,6-10H2,1,3H3,(H,14,16)/t11-/m0/s1 |
| InChIKey | BWMRDCVDOQHEKP-NSHDSACASA-N |
| Mol Weight | 255.31 g/mol |
| Molecular Formula | C13H21NO4 |
| Exact Mass | 255.147058 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 | ElV765wOZK2 |
|---|---|
| Name | L-Alanine, N-propargyloxycarbonyl-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.147058156 u |
| Formula | C13H21NO4 |
| InChI | InChI=1S/C13H21NO4/c1-4-6-7-8-10-17-12(15)11(3)14-13(16)18-9-5-2/h2,11H,4,6-10H2,1,3H3,(H,14,16)/t11-/m0/s1 |
| InChIKey | BWMRDCVDOQHEKP-NSHDSACASA-N |
| Molecular Weight | 255.314 g/mol |
| SMILES | CCCCCCOC([C@@](NC(OCC#C)=O)(C)[H])=O |