| SpectraBase Compound ID | riASDo2PNi |
|---|---|
| InChI | InChI=1S/C20H18OSe/c21-20(22-19-10-2-1-3-11-19)12-6-7-16-13-14-17-8-4-5-9-18(17)15-16/h1-5,8-11,13-15H,6-7,12H2 |
| InChIKey | NVVFBQZDVFIIMY-UHFFFAOYSA-N |
| Mol Weight | 353.33 g/mol |
| Molecular Formula | C20H18OSe |
| Exact Mass | 354.052287 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4IdtnRqd4N1 |
|---|---|
| Name | 2-Naphthalenbutanoselenoic acid, se-phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.052287199 u |
| Formula | C20H18OSe |
| InChI | InChI=1S/C20H18OSe/c21-20(22-19-10-2-1-3-11-19)12-6-7-16-13-14-17-8-4-5-9-18(17)15-16/h1-5,8-11,13-15H,6-7,12H2 |
| InChIKey | NVVFBQZDVFIIMY-UHFFFAOYSA-N |
| Molecular Weight | 353.335 g/mol |
| SMILES | C1=C2C=CC(CCCC(=O)[Se]C=3C=CC=CC3)=CC2=CC=C1 |