| SpectraBase Compound ID | G4bv2AUnHhg |
|---|---|
| InChI | InChI=1S/C10H11NO4/c12-7-3-4-8-15-10-6-2-1-5-9(10)11(13)14/h1-2,5-7H,3-4,8H2 |
| InChIKey | BFRSBBWZEWWEDN-UHFFFAOYSA-N |
| Mol Weight | 209.2 g/mol |
| Molecular Formula | C10H11NO4 |
| Exact Mass | 209.068808 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GuUGdlzqWzu |
|---|---|
| Name | 2-(3-Formylpropyloxy)nitrobenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.068807834 u |
| Formula | C10H11NO4 |
| InChI | InChI=1S/C10H11NO4/c12-7-3-4-8-15-10-6-2-1-5-9(10)11(13)14/h1-2,5-7H,3-4,8H2 |
| InChIKey | BFRSBBWZEWWEDN-UHFFFAOYSA-N |
| Molecular Weight | 209.201 g/mol |
| SMILES | C=1(C(=CC=CC1)OCCCC=O)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.864437 |