| SpectraBase Compound ID | 7emTlmSvAb2 |
|---|---|
| InChI | InChI=1S/C9H10N2O3/c1-2-10-9(12)7-3-5-8(6-4-7)11(13)14/h3-6H,2H2,1H3,(H,10,12) |
| InChIKey | RZUZNEBLPIHWAR-UHFFFAOYSA-N |
| Mol Weight | 194.19 g/mol |
| Molecular Formula | C9H10N2O3 |
| Exact Mass | 194.069142 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ClubY2oeR5B |
|---|---|
| Name | N-Ethyl-4-nitro-benzamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.069142187 u |
| Formula | C9H10N2O3 |
| InChI | InChI=1S/C9H10N2O3/c1-2-10-9(12)7-3-5-8(6-4-7)11(13)14/h3-6H,2H2,1H3,(H,10,12) |
| InChIKey | RZUZNEBLPIHWAR-UHFFFAOYSA-N |
| Molecular Weight | 194.190 g/mol |
| SMILES | C(C=1C=CC(=CC1)N(=O)=O)(=O)NCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.953543 |