SpectraBase Compound ID | DDfSvpFfE2a |
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InChI | InChI=1S/C6H10Br2/c1-5(7)3-4-6(2)8/h3-6H,1-2H3/b4-3- |
InChIKey | UQLCVPMPXJDZPX-ARJAWSKDSA-N |
Mol Weight | 241.95 g/mol |
Molecular Formula | C6H10Br2 |
Exact Mass | 239.914926 g/mol |
SpectraBase Spectrum ID | hGpuV0CwpF |
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Name | 3-Hexene, 2,5-dibromo- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 239.914926322 u |
Formula | C6H10Br2 |
InChI | InChI=1S/C6H10Br2/c1-5(7)3-4-6(2)8/h3-6H,1-2H3/b4-3- |
InChIKey | UQLCVPMPXJDZPX-ARJAWSKDSA-N |
Molecular Weight | 241.954 g/mol |
SMILES | C(\C=C/C(Br)C)(Br)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959526 |