| SpectraBase Compound ID | Jwg0b6DzVbd |
|---|---|
| InChI | InChI=1S/C17H18O2Se/c1-19-15-11-9-14(10-12-15)17(18)8-5-13-20-16-6-3-2-4-7-16/h2-4,6-7,9-12H,5,8,13H2,1H3 |
| InChIKey | VRRDXAMYWCYLQH-UHFFFAOYSA-N |
| Mol Weight | 333.3 g/mol |
| Molecular Formula | C17H18O2Se |
| Exact Mass | 334.047202 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D2IDstYnaXY |
|---|---|
| Name | 1-(4-Methoxyphenyl)-4-(phenylseleno)butan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.047201818 u |
| Formula | C17H18O2Se |
| InChI | InChI=1S/C17H18O2Se/c1-19-15-11-9-14(10-12-15)17(18)8-5-13-20-16-6-3-2-4-7-16/h2-4,6-7,9-12H,5,8,13H2,1H3 |
| InChIKey | VRRDXAMYWCYLQH-UHFFFAOYSA-N |
| Molecular Weight | 333.301 g/mol |
| SMILES | C=1(C=CC(OC)=CC1)C(=O)CCC[Se]C1=CC=CC=C1 |