SpectraBase Compound ID | 8c31UryJFuu |
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InChI | InChI=1S/C16H32Br2/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18/h1-16H2 |
InChIKey | OTFBUFWEFKVFFR-UHFFFAOYSA-N |
Mol Weight | 384.2 g/mol |
Molecular Formula | C16H32Br2 |
Exact Mass | 382.087077 g/mol |
SpectraBase Spectrum ID | IvqyGn9QDKx |
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Name | 1,16-Dibromohexadecane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 382.087077030 u |
Formula | C16H32Br2 |
InChI | InChI=1S/C16H32Br2/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18/h1-16H2 |
InChIKey | OTFBUFWEFKVFFR-UHFFFAOYSA-N |
Molecular Weight | 384.240 g/mol |
SMILES | C(Br)CCCCCCCCCCCCCCCBr |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.912744 |