| SpectraBase Compound ID | 7oHNjSYIf9U |
|---|---|
| InChI | InChI=1S/C12H15NO4/c1-3-16-11(14)9-6-5-8(13)7-10(9)12(15)17-4-2/h5-7H,3-4,13H2,1-2H3 |
| InChIKey | MPCAOTRSCWFYIJ-UHFFFAOYSA-N |
| Mol Weight | 237.25 g/mol |
| Molecular Formula | C12H15NO4 |
| Exact Mass | 237.100108 g/mol |
Vapor Phase (Gas) Infrared Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GqVMMb6oM6G |
|---|---|
| Name | Diethyl 4-aminophthalate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.100107963 u |
| Formula | C12H15NO4 |
| InChI | InChI=1S/C12H15NO4/c1-3-16-11(14)9-6-5-8(13)7-10(9)12(15)17-4-2/h5-7H,3-4,13H2,1-2H3 |
| InChIKey | MPCAOTRSCWFYIJ-UHFFFAOYSA-N |
| Molecular Weight | 237.255 g/mol |
| SMILES | C1(C(=O)OCC)=C(C=C(C=C1)N)C(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96907 |