| SpectraBase Compound ID | 4fbpqJdrfC3 |
|---|---|
| InChI | InChI=1S/C8H13NO4/c1-7(10)13-6-8(11)9-2-4-12-5-3-9/h2-6H2,1H3 |
| InChIKey | ZOEMPWSIKOJFAH-UHFFFAOYSA-N |
| Mol Weight | 187.19 g/mol |
| Molecular Formula | C8H13NO4 |
| Exact Mass | 187.084458 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7xixcurkQtY |
|---|---|
| Name | Acetoxyacetic acid, morpholide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.084457899 u |
| Formula | C8H13NO4 |
| InChI | InChI=1S/C8H13NO4/c1-7(10)13-6-8(11)9-2-4-12-5-3-9/h2-6H2,1H3 |
| InChIKey | ZOEMPWSIKOJFAH-UHFFFAOYSA-N |
| Molecular Weight | 187.195 g/mol |
| SMILES | CC(OCC(N1CCOCC1)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.974672 |