| SpectraBase Compound ID | Llxbs0Fhqfk |
|---|---|
| InChI | InChI=1S/C13H19NO5/c1-3-17-13(18-4-2)9-10-19-12-7-5-11(6-8-12)14(15)16/h5-8,13H,3-4,9-10H2,1-2H3 |
| InChIKey | OMULGZFZXXRXEF-UHFFFAOYSA-N |
| Mol Weight | 269.3 g/mol |
| Molecular Formula | C13H19NO5 |
| Exact Mass | 269.126323 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DVGQctb2tGP |
|---|---|
| Name | 1-(3,3-Diethoxypropoxy)-4-nitrobenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.126322711 u |
| Formula | C13H19NO5 |
| InChI | InChI=1S/C13H19NO5/c1-3-17-13(18-4-2)9-10-19-12-7-5-11(6-8-12)14(15)16/h5-8,13H,3-4,9-10H2,1-2H3 |
| InChIKey | OMULGZFZXXRXEF-UHFFFAOYSA-N |
| Molecular Weight | 269.297 g/mol |
| SMILES | C1=C(OCCC(OCC)OCC)C=CC(=C1)N(=O)=O |