![N-benzyl-2-[4-bromo-2-(hydroxymethyl)phenoxy]acetamide](/api/spectrum/82dSZfbt56o/structure.png?h=300&w=458 "N-benzyl-2-[4-bromo-2-(hydroxymethyl)phenoxy]acetamide")
| SpectraBase Compound ID | K5QtA4aXCjL |
|---|---|
| InChI | InChI=1S/C16H16BrNO3/c17-14-6-7-15(13(8-14)10-19)21-11-16(20)18-9-12-4-2-1-3-5-12/h1-8,19H,9-11H2,(H,18,20) |
| InChIKey | NJKPMZDFZVICQX-UHFFFAOYSA-N |
| Mol Weight | 350.21 g/mol |
| Molecular Formula | C16H16BrNO3 |
| Exact Mass | 349.031356 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 82dSZfbt56o |
|---|---|
| Name | N-Benzyl-2-[4-bromo-2-(hydroxymethyl)phenoxy]acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 349.031356376 u |
| Formula | C16H16BrNO3 |
| InChI | InChI=1S/C16H16BrNO3/c17-14-6-7-15(13(8-14)10-19)21-11-16(20)18-9-12-4-2-1-3-5-12/h1-8,19H,9-11H2,(H,18,20) |
| InChIKey | NJKPMZDFZVICQX-UHFFFAOYSA-N |
| Molecular Weight | 350.212 g/mol |
| SMILES | N(C(COC1=C(CO)C=C(C=C1)Br)=O)CC=1C=CC=CC1 |