| SpectraBase Compound ID | 8CwsX2ZeeJt |
|---|---|
| InChI | InChI=1S/C9H11NO4/c1-13-6-7-14-9-5-3-2-4-8(9)10(11)12/h2-5H,6-7H2,1H3 |
| InChIKey | DJTJGNJDSIOAOS-UHFFFAOYSA-N |
| Mol Weight | 197.19 g/mol |
| Molecular Formula | C9H11NO4 |
| Exact Mass | 197.068808 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 6uUR7fBWwLO |
|---|---|
| Name | Benzene, 1-(2-methoxyethoxy)-2-nitro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.068807834 u |
| Formula | C9H11NO4 |
| InChI | InChI=1S/C9H11NO4/c1-13-6-7-14-9-5-3-2-4-8(9)10(11)12/h2-5H,6-7H2,1H3 |
| InChIKey | DJTJGNJDSIOAOS-UHFFFAOYSA-N |
| Molecular Weight | 197.190 g/mol |
| SMILES | C1=C(C(=CC=C1)OCCOC)[N+]([O-])=O |
| Spectrum/Structure Validation Score (Raman) | 0.839122 |