| SpectraBase Compound ID | LbmY33PEmJq |
|---|---|
| InChI | InChI=1S/C16H27NO4/c1-5-7-9-10-11-13-20-15(18)14(3)17(4)16(19)21-12-8-6-2/h2,14H,5,7-13H2,1,3-4H3 |
| InChIKey | MIXQFMFQRJGCPE-UHFFFAOYSA-N |
| Mol Weight | 297.4 g/mol |
| Molecular Formula | C16H27NO4 |
| Exact Mass | 297.194008 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 | Ht0x13EvN4F |
|---|---|
| Name | dl-Alanine, N-methyl-N-(byt-3-yn-1-yloxycarbonyl)-, heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.194008349 u |
| Formula | C16H27NO4 |
| InChI | InChI=1S/C16H27NO4/c1-5-7-9-10-11-13-20-15(18)14(3)17(4)16(19)21-12-8-6-2/h2,14H,5,7-13H2,1,3-4H3 |
| InChIKey | MIXQFMFQRJGCPE-UHFFFAOYSA-N |
| Molecular Weight | 297.395 g/mol |
| SMILES | CC(N(C)C(=O)OCCC#C)C(=O)OCCCCCCC |