| SpectraBase Compound ID | HS9Ca04tpMi |
|---|---|
| InChI | InChI=1S/C12H13BrN2O3/c13-9-2-1-3-10(8-9)14-11(16)12(17)15-4-6-18-7-5-15/h1-3,8H,4-7H2,(H,14,16) |
| InChIKey | WAVQVDDQAUVSCY-UHFFFAOYSA-N |
| Mol Weight | 313.15 g/mol |
| Molecular Formula | C12H13BrN2O3 |
| Exact Mass | 312.010955 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LfrrJ8aeiM7 |
|---|---|
| Name | Acetamide, 2-(4-morpholyl)-2-oxo-N-(3-bromophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.010955284 u |
| Formula | C12H13BrN2O3 |
| InChI | InChI=1S/C12H13BrN2O3/c13-9-2-1-3-10(8-9)14-11(16)12(17)15-4-6-18-7-5-15/h1-3,8H,4-7H2,(H,14,16) |
| InChIKey | WAVQVDDQAUVSCY-UHFFFAOYSA-N |
| Molecular Weight | 313.151 g/mol |
| SMILES | C(C(N1CCOCC1)=O)(NC1=CC=CC(=C1)Br)=O |