| SpectraBase Compound ID | GsnHlOgwOtc |
|---|---|
| InChI | InChI=1S/CHBrClNO2/c2-1(3)4(5)6/h1H |
| InChIKey | QUGLTGHXUDTPKJ-UHFFFAOYSA-N |
| Mol Weight | 174.38 g/mol |
| Molecular Formula | CHBrClNO2 |
| Exact Mass | 172.887919 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1QN7EGY1Yrc |
|---|---|
| Name | Bromochloronitromethane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.887918974 u |
| Formula | CHBrClNO2 |
| InChI | InChI=1S/CHBrClNO2/c2-1(3)4(5)6/h1H |
| InChIKey | QUGLTGHXUDTPKJ-UHFFFAOYSA-N |
| SMILES | C(N(=O)=O)(Cl)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.837138 |