| SpectraBase Compound ID | GktoITDnfNE |
|---|---|
| InChI | InChI=1S/C10H12BrNO/c1-7-4-3-5-9(6-7)12-10(13)8(2)11/h3-6,8H,1-2H3,(H,12,13) |
| InChIKey | JWZPPAQMKDCYJG-UHFFFAOYSA-N |
| Mol Weight | 242.12 g/mol |
| Molecular Formula | C10H12BrNO |
| Exact Mass | 241.010227 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7gpHLW3gP13 |
|---|---|
| Name | Propanamide, N-(3-methylphenyl)-2-bromo- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.010227009 u |
| Formula | C10H12BrNO |
| InChI | InChI=1S/C10H12BrNO/c1-7-4-3-5-9(6-7)12-10(13)8(2)11/h3-6,8H,1-2H3,(H,12,13) |
| InChIKey | JWZPPAQMKDCYJG-UHFFFAOYSA-N |
| Molecular Weight | 242.116 g/mol |
| SMILES | C(C(NC1=CC(C)=CC=C1)=O)(C)Br |