| SpectraBase Compound ID | 2Tk2vpFCjsW |
|---|---|
| InChI | InChI=1S/C17H18BrNO/c1-2-20-17(15-9-4-3-5-10-15)19-13-12-14-8-6-7-11-16(14)18/h3-11H,2,12-13H2,1H3/b19-17+ |
| InChIKey | BXDDKYTWSFUGEV-HTXNQAPBSA-N |
| Mol Weight | 332.24 g/mol |
| Molecular Formula | C17H18BrNO |
| Exact Mass | 331.057177 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CHSCbgY5Ar7 |
|---|---|
| Name | Ethyl N-2-(2-bromophenyl)ethylbenzimidate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.057177203 u |
| Formula | C17H18BrNO |
| InChI | InChI=1S/C17H18BrNO/c1-2-20-17(15-9-4-3-5-10-15)19-13-12-14-8-6-7-11-16(14)18/h3-11H,2,12-13H2,1H3/b19-17+ |
| InChIKey | BXDDKYTWSFUGEV-HTXNQAPBSA-N |
| Molecular Weight | 332.241 g/mol |
| SMILES | C(\N=C/(C1=CC=CC=C1)OCC)CC=1C(Br)=CC=CC1 |