| SpectraBase Compound ID | 7QzZSJE8hf5 |
|---|---|
| InChI | InChI=1S/C14H14BrNO2/c1-10-2-7-14(18-10)13(17)8-9-16-12-5-3-11(15)4-6-12/h2-7,16H,8-9H2,1H3 |
| InChIKey | RKGNSHZNUQVICP-UHFFFAOYSA-N |
| Mol Weight | 308.18 g/mol |
| Molecular Formula | C14H14BrNO2 |
| Exact Mass | 307.020792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KY0XkzvFFDU |
|---|---|
| Name | 3-(4-Bromo-phenylamino)-1-(5-methyl-furan-2-yl)-propan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.020791693 u |
| Formula | C14H14BrNO2 |
| InChI | InChI=1S/C14H14BrNO2/c1-10-2-7-14(18-10)13(17)8-9-16-12-5-3-11(15)4-6-12/h2-7,16H,8-9H2,1H3 |
| InChIKey | RKGNSHZNUQVICP-UHFFFAOYSA-N |
| Molecular Weight | 308.175 g/mol |
| SMILES | C=1(OC(C)=CC1)C(=O)CCNC=1C=CC(=CC1)Br |