| SpectraBase Compound ID | LjgptNlplEp |
|---|---|
| InChI | InChI=1S/C19H22Br2O/c20-10-4-8-17-12-18(9-5-11-21)14-19(13-17)22-15-16-6-2-1-3-7-16/h1-3,6-7,12-14H,4-5,8-11,15H2 |
| InChIKey | YQXOUBLGUYXSAK-UHFFFAOYSA-N |
| Mol Weight | 426.19 g/mol |
| Molecular Formula | C19H22Br2O |
| Exact Mass | 424.003741 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EGIm5D7qtNJ |
|---|---|
| Name | 1,3-bis(3-Bromopropyl)-5-benzyloxybenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 424.003741327 u |
| Formula | C19H22Br2O |
| InChI | InChI=1S/C19H22Br2O/c20-10-4-8-17-12-18(9-5-11-21)14-19(13-17)22-15-16-6-2-1-3-7-16/h1-3,6-7,12-14H,4-5,8-11,15H2 |
| InChIKey | YQXOUBLGUYXSAK-UHFFFAOYSA-N |
| Molecular Weight | 426.192 g/mol |
| SMILES | C=1(C=C(C=C(C1)OCC=1C=CC=CC1)CCCBr)CCCBr |