| SpectraBase Compound ID | 4L7fgYg0Dus |
|---|---|
| InChI | InChI=1S/C10H14Br2Cl2O2/c1-9(12,5-13)8-3-7(15)10(2,16-8)6(14)4-11/h4,7-8,15H,3,5H2,1-2H3/b6-4-/t7-,8+,9?,10+/m0/s1 |
| InChIKey | KUMNGEFTSKDDEM-GJPPBFKQSA-N |
| Mol Weight | 396.93 g/mol |
| Molecular Formula | C10H14Br2Cl2O2 |
| Exact Mass | 393.873761 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DdqV1xWuFIs |
|---|---|
| Name | Furoplocamioid-B |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 393.873761089 u |
| Formula | C10H14Br2Cl2O2 |
| InChI | InChI=1S/C10H14Br2Cl2O2/c1-9(12,5-13)8-3-7(15)10(2,16-8)6(14)4-11/h4,7-8,15H,3,5H2,1-2H3/b6-4-/t7-,8+,9?,10+/m0/s1 |
| InChIKey | KUMNGEFTSKDDEM-GJPPBFKQSA-N |
| Molecular Weight | 396.934 g/mol |
| SMILES | [C@@]1(\C(=C\Br)Cl)([C@@](O)(C[C@@](O1)(C(Br)(CCl)C)[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.811877 |