| SpectraBase Compound ID | CVQy1wvBzUE |
|---|---|
| InChI | InChI=1S/C12H24BrNO/c1-3-5-7-11(4-2)10-14-12(15)8-6-9-13/h11H,3-10H2,1-2H3,(H,14,15) |
| InChIKey | SLKGIZSSWGUTSJ-UHFFFAOYSA-N |
| Mol Weight | 278.23 g/mol |
| Molecular Formula | C12H24BrNO |
| Exact Mass | 277.104127 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1aN3G4iJkVs |
|---|---|
| Name | Butyramide, 4-bromo-N-2-ethylhexyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.104127396 u |
| Formula | C12H24BrNO |
| InChI | InChI=1S/C12H24BrNO/c1-3-5-7-11(4-2)10-14-12(15)8-6-9-13/h11H,3-10H2,1-2H3,(H,14,15) |
| InChIKey | SLKGIZSSWGUTSJ-UHFFFAOYSA-N |
| SMILES | C(CCCBr)(NCC(CCCC)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.982306 |