| SpectraBase Compound ID | Ll4HsTlldiw |
|---|---|
| InChI | InChI=1S/C16H15BrO3/c1-19-12-8-9-13(14(10-12)20-2)16(18)15(17)11-6-4-3-5-7-11/h3-10,15H,1-2H3 |
| InChIKey | NITDJFVICUITLF-UHFFFAOYSA-N |
| Mol Weight | 335.2 g/mol |
| Molecular Formula | C16H15BrO3 |
| Exact Mass | 334.020457 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 57tKKQMOuUK |
|---|---|
| Name | 2-Bromanyl-1-(2,4-dimethoxyphenyl)-2-phenyl-ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.020457340 u |
| Formula | C16H15BrO3 |
| InChI | InChI=1S/C16H15BrO3/c1-19-12-8-9-13(14(10-12)20-2)16(18)15(17)11-6-4-3-5-7-11/h3-10,15H,1-2H3 |
| InChIKey | NITDJFVICUITLF-UHFFFAOYSA-N |
| Molecular Weight | 335.197 g/mol |
| SMILES | C=1(C(C(C=2C=CC=CC2)Br)=O)C(=CC(=CC1)OC)OC |