![Ethyl 4-[(2-phenylseleno)phenyl]benzoate](/api/spectrum/KiGrlB1Tg7u/structure.png?h=300&w=458 "Ethyl 4-[(2-phenylseleno)phenyl]benzoate")
| SpectraBase Compound ID | 2Aw8bAbjhmo |
|---|---|
| InChI | InChI=1S/C21H18O2Se/c1-2-23-21(22)17-14-12-16(13-15-17)19-10-6-7-11-20(19)24-18-8-4-3-5-9-18/h3-15H,2H2,1H3 |
| InChIKey | XTGZNLUFELXLOM-UHFFFAOYSA-N |
| Mol Weight | 381.34 g/mol |
| Molecular Formula | C21H18O2Se |
| Exact Mass | 382.047202 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KiGrlB1Tg7u |
|---|---|
| Name | Ethyl 4-[(2-phenylseleno)phenyl]benzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 382.047201818 u |
| Formula | C21H18O2Se |
| InChI | InChI=1S/C21H18O2Se/c1-2-23-21(22)17-14-12-16(13-15-17)19-10-6-7-11-20(19)24-18-8-4-3-5-9-18/h3-15H,2H2,1H3 |
| InChIKey | XTGZNLUFELXLOM-UHFFFAOYSA-N |
| Molecular Weight | 381.345 g/mol |
| SMILES | C=1([Se]C2=CC=CC=C2)C(C2=CC=C(C(=O)OCC)C=C2)=CC=CC1 |