![2-Propenoic acid, 3-[(methoxycarbonyl)amino]-, methyl ester, (E)-](/api/spectrum/9MlaL6Bs5hK/structure.png?h=300&w=458 "2-Propenoic acid, 3-[(methoxycarbonyl)amino]-, methyl ester, (E)-")
| SpectraBase Compound ID | AdCF6c4JlPd |
|---|---|
| InChI | InChI=1S/C6H9NO4/c1-10-5(8)3-4-7-6(9)11-2/h3-4H,1-2H3,(H,7,9)/b4-3+ |
| InChIKey | SRHYKZOVYDLBSM-ONEGZZNKSA-N |
| Mol Weight | 159.14 g/mol |
| Molecular Formula | C6H9NO4 |
| Exact Mass | 159.053158 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9MlaL6Bs5hK |
|---|---|
| Name | 2-Propenoic acid, 3-[(methoxycarbonyl)amino]-, methyl ester, (E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 159.053157770 u |
| Formula | C6H9NO4 |
| InChI | InChI=1S/C6H9NO4/c1-10-5(8)3-4-7-6(9)11-2/h3-4H,1-2H3,(H,7,9)/b4-3+ |
| InChIKey | SRHYKZOVYDLBSM-ONEGZZNKSA-N |
| SMILES | N(C(OC)=O)\C=C\C(OC)=O |