SpectraBase Compound ID | 7T66dGJihmR |
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InChI | InChI=1S/CBr2FNO2/c2-1(3,4)5(6)7 |
InChIKey | XAXXACIJJIYJSM-UHFFFAOYSA-N |
Mol Weight | 236.822 g/mol |
Molecular Formula | CBr2FNO2 |
Exact Mass | 234.827982 g/mol |
SpectraBase Spectrum ID | 6EWkR4peEdM |
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Name | Dibromofluoronitromethane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 234.827982405 u |
Formula | CBr2FNO2 |
InChI | InChI=1S/CBr2FNO2/c2-1(3,4)5(6)7 |
InChIKey | XAXXACIJJIYJSM-UHFFFAOYSA-N |
Molecular Weight | 236.822 g/mol |
SMILES | C(N(=O)=O)(F)(Br)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955226 |