| SpectraBase Spectrum ID |
8hFPkLfV3xx |
| Name |
(Trans)-3-bromo-1-isopropyl-2-methylpyrrolidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
205.046612519 u |
| Formula |
C8H16BrN |
| InChI |
InChI=1S/C8H16BrN/c1-6(2)10-5-4-8(9)7(10)3/h6-8H,4-5H2,1-3H3/t7-,8+/m1/s1 |
| InChIKey |
BAYYOYUEZYOYBJ-SFYZADRCSA-N |
| Molecular Weight |
206.127 g/mol |
| SMILES |
[C@]1(N(CC[C@@]1(Br)[H])C(C)C)(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.904319 |
