| SpectraBase Compound ID | FxpYtpJcA2s |
|---|---|
| InChI | InChI=1S/C12H16BrNO/c1-10(13)12(15)14(2)9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey | MMWUNVUPEPROLI-UHFFFAOYSA-N |
| Mol Weight | 270.17 g/mol |
| Molecular Formula | C12H16BrNO |
| Exact Mass | 269.041527 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KnBUwnu6rpO |
|---|---|
| Name | Propanamide, 2-bromo-N-(2-phenylethyl)-N-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.041527138 u |
| Formula | C12H16BrNO |
| InChI | InChI=1S/C12H16BrNO/c1-10(13)12(15)14(2)9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey | MMWUNVUPEPROLI-UHFFFAOYSA-N |
| Molecular Weight | 270.170 g/mol |
| SMILES | C1=CC=CC(=C1)CCN(C(=O)C(Br)C)C |