| SpectraBase Compound ID | 5f8082ZqsYe |
|---|---|
| InChI | InChI=1S/C9H8BrNO5/c1-15-7-3-6(10)8(11(13)14)5(4-12)9(7)16-2/h3-4H,1-2H3 |
| InChIKey | USMPGJSZPRZGMQ-UHFFFAOYSA-N |
| Mol Weight | 290.07 g/mol |
| Molecular Formula | C9H8BrNO5 |
| Exact Mass | 288.958585 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 | 4Sdp67bCR8N |
|---|---|
| Name | 5-Bromo-2,3-dimethoxy-6-nitrobenzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.958585357 u |
| Formula | C9H8BrNO5 |
| InChI | InChI=1S/C9H8BrNO5/c1-15-7-3-6(10)8(11(13)14)5(4-12)9(7)16-2/h3-4H,1-2H3 |
| InChIKey | USMPGJSZPRZGMQ-UHFFFAOYSA-N |
| SMILES | C1(=C(C=C(C(=C1C=O)OC)OC)Br)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952255 |