SpectraBase Compound ID | 9W7O0F32uFT |
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InChI | InChI=1S/C8H16Br2O/c1-7(2,10)8(3,4)11-6-5-9/h5-6H2,1-4H3 |
InChIKey | LTVFBCUXAAIAPT-UHFFFAOYSA-N |
Mol Weight | 288.02 g/mol |
Molecular Formula | C8H16Br2O |
Exact Mass | 285.956791 g/mol |
SpectraBase Spectrum ID | FFbqjAzCM4H |
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Name | 2-Bromo-3-(2-bromoethoxy)-2,3-dimethylbutane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 285.956791134 u |
Formula | C8H16Br2O |
InChI | InChI=1S/C8H16Br2O/c1-7(2,10)8(3,4)11-6-5-9/h5-6H2,1-4H3 |
InChIKey | LTVFBCUXAAIAPT-UHFFFAOYSA-N |
SMILES | C(OCCBr)(C(C)(C)Br)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97667 |