SpectraBase Compound ID | AL2XHKqer9m |
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InChI | InChI=1S/CBrN/c2-1-3 |
InChIKey | ATDGTVJJHBUTRL-UHFFFAOYSA-N |
Mol Weight | 105.922 g/mol |
Molecular Formula | CBrN |
Exact Mass | 104.921412 g/mol |
SpectraBase Spectrum ID | 4w9DTv3KsJD |
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Name | Cyanbromide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 104.921412004 u |
Formula | CBrN |
InChI | InChI=1S/CBrN/c2-1-3 |
InChIKey | ATDGTVJJHBUTRL-UHFFFAOYSA-N |
SMILES | C(#N)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.806025 |