| SpectraBase Compound ID | CjutYXKA3DU |
|---|---|
| InChI | InChI=1S/C16H23Br/c1-2-3-4-13-5-7-14(8-6-13)15-9-11-16(17)12-10-15/h9-14H,2-8H2,1H3 |
| InChIKey | NFLACFCPGPQOFJ-UHFFFAOYSA-N |
| Mol Weight | 295.26 g/mol |
| Molecular Formula | C16H23Br |
| Exact Mass | 294.098314 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ziqL5T9q93 |
|---|---|
| Name | 1-Bromo-4-(trans-4-butylcyclohexyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.098313741 u |
| Formula | C16H23Br |
| InChI | InChI=1S/C16H23Br/c1-2-3-4-13-5-7-14(8-6-13)15-9-11-16(17)12-10-15/h9-14H,2-8H2,1H3 |
| InChIKey | NFLACFCPGPQOFJ-UHFFFAOYSA-N |
| SMILES | C1(Br)=CC=C(C=C1)C1CCC(CC1)CCCC |