| SpectraBase Compound ID | 7NMDDrDIqYj |
|---|---|
| InChI | InChI=1S/C7H6ClNO3/c1-12-7-3-2-5(9(10)11)4-6(7)8/h2-4H,1H3 |
| InChIKey | DLJPNXLHWMRQIQ-UHFFFAOYSA-N |
| Mol Weight | 187.58 g/mol |
| Molecular Formula | C7H6ClNO3 |
| Exact Mass | 187.003621 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 | 4ukYSvMSwhw |
|---|---|
| Name | Benzene, 2-chloro-1-methoxy-4-nitro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.003620754 u |
| Formula | C7H6ClNO3 |
| InChI | InChI=1S/C7H6ClNO3/c1-12-7-3-2-5(9(10)11)4-6(7)8/h2-4H,1H3 |
| InChIKey | DLJPNXLHWMRQIQ-UHFFFAOYSA-N |
| SMILES | C1=C(C(=CC=C1N(=O)=O)OC)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952792 |