| SpectraBase Compound ID | 9070OB9wdLK |
|---|---|
| InChI | InChI=1S/2C16H13NO4/c2*18-14(11-5-2-1-3-6-11)10-15(19)17-13-8-4-7-12(9-13)16(20)21/h1-9H,10H2,(H,17,19)(H,20,21);1-10,18H,(H,17,19)(H,20,21)/b;14-10- |
| InChIKey | QPEZINUIDLMZJV-KVIVADCXSA-N |
| Mol Weight | 283.28 g/mol |
| Molecular Formula | C16H13NO4 |
| Exact Mass | 283.084458 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 3oIuGMLCFeJ |
|---|---|
| Name | (3E)-1-(3-acetylphenyl)-4-phenylpent-3-en-2-one; 4-(3-acetylphenyl)-1-phenylbutane-1,3-dione |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.084457899 u |
| Formula | C16H13NO4 |
| InChI | InChI=1S/2C16H13NO4/c2*18-14(11-5-2-1-3-6-11)10-15(19)17-13-8-4-7-12(9-13)16(20)21/h1-9H,10H2,(H,17,19)(H,20,21);1-10,18H,(H,17,19)(H,20,21)/b;14-10- |
| InChIKey | QPEZINUIDLMZJV-KVIVADCXSA-N |
| Molecular Weight | 283.283 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2017_1156 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: IOCH-250/4020184; Lab Info:Shostakovskiy |