| SpectraBase Compound ID | L3gKJiKS0pD |
|---|---|
| InChI | InChI=1S/CBr2ClNO2/c2-1(3,4)5(6)7 |
| InChIKey | TWDGXJVDOONOHS-UHFFFAOYSA-N |
| Mol Weight | 253.28 g/mol |
| Molecular Formula | CBr2ClNO2 |
| Exact Mass | 250.798432 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H2SsTUqTeB8 |
|---|---|
| Name | Dibromochloronitromethane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.798431942 u |
| Formula | CBr2ClNO2 |
| InChI | InChI=1S/CBr2ClNO2/c2-1(3,4)5(6)7 |
| InChIKey | TWDGXJVDOONOHS-UHFFFAOYSA-N |
| SMILES | C(N(=O)=O)(Cl)(Br)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.83955 |