| SpectraBase Compound ID | 38GEArTlZfY |
|---|---|
| InChI | InChI=1S/C13H26BrNO/c1-3-4-5-6-7-8-9-10-11-15-13(16)12(2)14/h12H,3-11H2,1-2H3,(H,15,16)/t12-/m0/s1 |
| InChIKey | BIBZEMGOHWHQJJ-LBPRGKRZSA-N |
| Mol Weight | 292.26 g/mol |
| Molecular Formula | C13H26BrNO |
| Exact Mass | 291.119777 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JkbbuWujsXK |
|---|---|
| Name | (S)-(-)-N-decyl-2-bromopropionamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.119777460 u |
| Formula | C13H26BrNO |
| InChI | InChI=1S/C13H26BrNO/c1-3-4-5-6-7-8-9-10-11-15-13(16)12(2)14/h12H,3-11H2,1-2H3,(H,15,16)/t12-/m0/s1 |
| InChIKey | BIBZEMGOHWHQJJ-LBPRGKRZSA-N |
| SMILES | C(=O)(NCCCCCCCCCC)[C@@](Br)(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96024 |