| SpectraBase Compound ID | 2Y01puoyNky |
|---|---|
| InChI | InChI=1S/C12H17NO4/c1-4-7-10(11(14)16-8-5-2)13-12(15)17-9-6-3/h4-6,10H,1-3,7-9H2,(H,13,15) |
| InChIKey | ZGWKBTFWZSAZRZ-UHFFFAOYSA-N |
| Mol Weight | 239.27 g/mol |
| Molecular Formula | C12H17NO4 |
| Exact Mass | 239.115758 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9hg1kxyNhZb |
|---|---|
| Name | L-Allylglycine, N-allyloxycarbonyl-, allyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.115758027 u |
| Formula | C12H17NO4 |
| InChI | InChI=1S/C12H17NO4/c1-4-7-10(11(14)16-8-5-2)13-12(15)17-9-6-3/h4-6,10H,1-3,7-9H2,(H,13,15) |
| InChIKey | ZGWKBTFWZSAZRZ-UHFFFAOYSA-N |
| Molecular Weight | 239.271 g/mol |
| SMILES | C=CCOC(NC(CC=C)C(OCC=C)=O)=O |