![4-[(Z)-3-bromanylprop-2-enoxy]benzenecarbonitrile](/api/spectrum/LiNfxS7IoWA/structure.png?h=300&w=458 "4-[(Z)-3-bromanylprop-2-enoxy]benzenecarbonitrile")
| SpectraBase Compound ID | 1Q2TJaF0EdN |
|---|---|
| InChI | InChI=1S/C10H8BrNO/c11-6-1-7-13-10-4-2-9(8-12)3-5-10/h1-6H,7H2/b6-1- |
| InChIKey | DIMYKZQMCGATHN-BHQIHCQQSA-N |
| Mol Weight | 238.08 g/mol |
| Molecular Formula | C10H8BrNO |
| Exact Mass | 236.978927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LiNfxS7IoWA |
|---|---|
| Name | 4-[(Z)-3-Bromanylprop-2-enoxy]benzenecarbonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.978926881 u |
| Formula | C10H8BrNO |
| InChI | InChI=1S/C10H8BrNO/c11-6-1-7-13-10-4-2-9(8-12)3-5-10/h1-6H,7H2/b6-1- |
| InChIKey | DIMYKZQMCGATHN-BHQIHCQQSA-N |
| Molecular Weight | 238.084 g/mol |
| SMILES | C(#N)C1=CC=C(C=C1)OC\C=C/Br |