| SpectraBase Compound ID | 7hpjyGCQnIC |
|---|---|
| InChI | InChI=1S/C14H10BrNO2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(17)18/h1-10H/b2-1+ |
| InChIKey | DFAOJKUHONBIMN-OWOJBTEDSA-N |
| Mol Weight | 304.14 g/mol |
| Molecular Formula | C14H10BrNO2 |
| Exact Mass | 302.989492 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LMmKt0iD1jg |
|---|---|
| Name | (Trans)-4-(4'-bromostyryl)-1-nitrobenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.989491564 u |
| Formula | C14H10BrNO2 |
| InChI | InChI=1S/C14H10BrNO2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(17)18/h1-10H/b2-1+ |
| InChIKey | DFAOJKUHONBIMN-OWOJBTEDSA-N |
| Molecular Weight | 304.143 g/mol |
| SMILES | C=1(N(=O)=O)C=CC(\C=C\C=2C=CC(Br)=CC2)=CC1 |