| SpectraBase Compound ID | BPPc6TE0eKF |
|---|---|
| InChI | InChI=1S/C15H13NO4/c1-20-14-8-4-12(5-9-14)15(17)10-11-2-6-13(7-3-11)16(18)19/h2-9H,10H2,1H3 |
| InChIKey | QZRYDWIIQOTRSV-UHFFFAOYSA-N |
| Mol Weight | 271.27 g/mol |
| Molecular Formula | C15H13NO4 |
| Exact Mass | 271.084458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AyREqNldnID |
|---|---|
| Name | 1-(4-Methoxyphenyl)-2-(4-nitrophenyl)ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.084457899 u |
| Formula | C15H13NO4 |
| InChI | InChI=1S/C15H13NO4/c1-20-14-8-4-12(5-9-14)15(17)10-11-2-6-13(7-3-11)16(18)19/h2-9H,10H2,1H3 |
| InChIKey | QZRYDWIIQOTRSV-UHFFFAOYSA-N |
| SMILES | C1(N(=O)=O)=CC=C(CC(C=2C=CC(=CC2)OC)=O)C=C1 |