| SpectraBase Compound ID | C5dubn54IlI |
|---|---|
| InChI | InChI=1S/C17H13BrO/c1-12-11-16(13-7-9-15(18)10-8-13)19-17(12)14-5-3-2-4-6-14/h2-11H,1H3 |
| InChIKey | HKBVDSBLQSAQOF-UHFFFAOYSA-N |
| Mol Weight | 313.19 g/mol |
| Molecular Formula | C17H13BrO |
| Exact Mass | 312.014978 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hxu4MC44rJE |
|---|---|
| Name | 5-(4-Bromophenyl)-3-methyl-2-phenylfuran |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.014978038 u |
| Formula | C17H13BrO |
| InChI | InChI=1S/C17H13BrO/c1-12-11-16(13-7-9-15(18)10-8-13)19-17(12)14-5-3-2-4-6-14/h2-11H,1H3 |
| InChIKey | HKBVDSBLQSAQOF-UHFFFAOYSA-N |
| Molecular Weight | 313.194 g/mol |
| SMILES | C=1(OC(=CC1C)C1=CC=C(C=C1)Br)C=1C=CC=CC1 |