![Methyl (S)-2-[(benzyloxy)carbonylamino]-3-(furan-2'-yl)propanoate](/api/spectrum/37hrTtanArX/structure.png?h=300&w=458 "Methyl (S)-2-[(benzyloxy)carbonylamino]-3-(furan-2'-yl)propanoate")
| SpectraBase Compound ID | AOB9RjFv8Fj |
|---|---|
| InChI | InChI=1S/C16H17NO5/c1-20-15(18)14(10-13-8-5-9-21-13)17-16(19)22-11-12-6-3-2-4-7-12/h2-9,14H,10-11H2,1H3,(H,17,19)/t14-/m0/s1 |
| InChIKey | QKXGLDFNPRRJKP-AWEZNQCLSA-N |
| Mol Weight | 303.31 g/mol |
| Molecular Formula | C16H17NO5 |
| Exact Mass | 303.110673 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 37hrTtanArX |
|---|---|
| Name | Methyl (S)-2-[(benzyloxy)carbonylamino]-3-(furan-2'-yl)propanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.110672646 u |
| Formula | C16H17NO5 |
| InChI | InChI=1S/C16H17NO5/c1-20-15(18)14(10-13-8-5-9-21-13)17-16(19)22-11-12-6-3-2-4-7-12/h2-9,14H,10-11H2,1H3,(H,17,19)/t14-/m0/s1 |
| InChIKey | QKXGLDFNPRRJKP-AWEZNQCLSA-N |
| SMILES | C(N[C@](C(=O)OC)(CC=1OC=CC1)[H])(=O)OCC1=CC=CC=C1 |