![{[1-(4-Ethoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]amino}acetonitrile](/api/spectrum/KUGZ7VYokHy/structure.png?h=300&w=458 "{[1-(4-Ethoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]amino}acetonitrile")
| SpectraBase Compound ID | JHht9NV61yq |
|---|---|
| InChI | InChI=1S/C14H15N3O3/c1-2-20-11-5-3-10(4-6-11)17-13(18)9-12(14(17)19)16-8-7-15/h3-6,12,16H,2,8-9H2,1H3 |
| InChIKey | LNKOACNOJFAKRD-UHFFFAOYSA-N |
| Mol Weight | 273.29 g/mol |
| Molecular Formula | C14H15N3O3 |
| Exact Mass | 273.111341 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KUGZ7VYokHy |
|---|---|
| Name | {[1-(4-Ethoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]amino}acetonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.111341352 u |
| Formula | C14H15N3O3 |
| InChI | InChI=1S/C14H15N3O3/c1-2-20-11-5-3-10(4-6-11)17-13(18)9-12(14(17)19)16-8-7-15/h3-6,12,16H,2,8-9H2,1H3 |
| InChIKey | LNKOACNOJFAKRD-UHFFFAOYSA-N |
| Molecular Weight | 273.292 g/mol |
| SMILES | N(C1C(N(C(C1)=O)C=1C=CC(=CC1)OCC)=O)CC#N |