| SpectraBase Compound ID | 1w8lvOFTLCw |
|---|---|
| InChI | InChI=1S/C10H14BrN/c1-12(2)8-7-9-5-3-4-6-10(9)11/h3-6H,7-8H2,1-2H3 |
| InChIKey | CEQDOZNXFWUMTG-UHFFFAOYSA-N |
| Mol Weight | 228.13 g/mol |
| Molecular Formula | C10H14BrN |
| Exact Mass | 227.030962 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EKiGvk98xWi |
|---|---|
| Name | N,N-Dimethyl-2-bromophenethylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.030962455 u |
| Formula | C10H14BrN |
| InChI | InChI=1S/C10H14BrN/c1-12(2)8-7-9-5-3-4-6-10(9)11/h3-6H,7-8H2,1-2H3 |
| InChIKey | CEQDOZNXFWUMTG-UHFFFAOYSA-N |
| Molecular Weight | 228.133 g/mol |
| SMILES | C=1(C(=CC=CC1)Br)CCN(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.923965 |