| SpectraBase Compound ID | Hz2XwUC7bWI |
|---|---|
| InChI | InChI=1S/C12H16BrNO/c1-4-14(3)9(2)12(15)10-5-7-11(13)8-6-10/h5-9H,4H2,1-3H3 |
| InChIKey | VEVPGMWFBGKGMC-UHFFFAOYSA-N |
| Mol Weight | 270.17 g/mol |
| Molecular Formula | C12H16BrNO |
| Exact Mass | 269.041527 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DiiEPJpMEIb |
|---|---|
| Name | N-Ethyl,N-methyl-4-bromocathinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.041527138 u |
| Formula | C12H16BrNO |
| InChI | InChI=1S/C12H16BrNO/c1-4-14(3)9(2)12(15)10-5-7-11(13)8-6-10/h5-9H,4H2,1-3H3 |
| InChIKey | VEVPGMWFBGKGMC-UHFFFAOYSA-N |
| Molecular Weight | 270.170 g/mol |
| SMILES | C=1(C(C(N(CC)C)C)=O)C=CC(=CC1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.892549 |