| SpectraBase Spectrum ID |
JfhH3DEtKy3 |
| Name |
(S)-(-)-N-octyl-2-bromopropionamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
263.088477331 u |
| Formula |
C11H22BrNO |
| InChI |
InChI=1S/C11H22BrNO/c1-3-4-5-6-7-8-9-13-11(14)10(2)12/h10H,3-9H2,1-2H3,(H,13,14)/t10-/m0/s1 |
| InChIKey |
LMRCLSJUMLJMJY-JTQLQIEISA-N |
| Molecular Weight |
264.207 g/mol |
| SMILES |
C(=O)(NCCCCCCCC)[C@@](Br)(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966865 |
