| SpectraBase Compound ID | ATF08bngwnX |
|---|---|
| InChI | InChI=1S/C15H25NO4/c1-5-7-9-10-12-19-14(17)13(3)16(4)15(18)20-11-8-6-2/h2,13H,5,7-12H2,1,3-4H3 |
| InChIKey | JUFDEMFANLEZAH-UHFFFAOYSA-N |
| Mol Weight | 283.37 g/mol |
| Molecular Formula | C15H25NO4 |
| Exact Mass | 283.178358 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7h2WvG7IsCP |
|---|---|
| Name | dl-Alanine, N-methyl-N-(byt-3-yn-1-yloxycarbonyl)-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.178358285 u |
| Formula | C15H25NO4 |
| InChI | InChI=1S/C15H25NO4/c1-5-7-9-10-12-19-14(17)13(3)16(4)15(18)20-11-8-6-2/h2,13H,5,7-12H2,1,3-4H3 |
| InChIKey | JUFDEMFANLEZAH-UHFFFAOYSA-N |
| SMILES | CC(N(C)C(=O)OCCC#C)C(=O)OCCCCCC |