| SpectraBase Compound ID | EvfEcXxJRqj |
|---|---|
| InChI | InChI=1S/C7H14BrN/c1-6(8)5-9-7(2,3)4/h9H,1,5H2,2-4H3 |
| InChIKey | SOKMNXWEVHTGMT-UHFFFAOYSA-N |
| Mol Weight | 192.1 g/mol |
| Molecular Formula | C7H14BrN |
| Exact Mass | 191.030962 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 88vb0gS2JDS |
|---|---|
| Name | (2-Bromo-allyl)-tert-butyl-amine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 191.030962455 u |
| Formula | C7H14BrN |
| InChI | InChI=1S/C7H14BrN/c1-6(8)5-9-7(2,3)4/h9H,1,5H2,2-4H3 |
| InChIKey | SOKMNXWEVHTGMT-UHFFFAOYSA-N |
| Molecular Weight | 192.100 g/mol |
| SMILES | C(=C)(CNC(C)(C)C)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.938724 |