![4-[(p-Bromophenyl)thio]-2-butenyl p-tolyl ether](/api/spectrum/8yKZfe6G1lh/structure.png?h=300&w=458 "4-[(p-Bromophenyl)thio]-2-butenyl p-tolyl ether")
| SpectraBase Compound ID | IL8tqQknJ8z |
|---|---|
| InChI | InChI=1S/C17H17BrOS/c1-14-4-8-16(9-5-14)19-12-2-3-13-20-17-10-6-15(18)7-11-17/h2-11H,12-13H2,1H3 |
| InChIKey | VOAFFFSPOKYJMG-UHFFFAOYSA-N |
| Mol Weight | 349.29 g/mol |
| Molecular Formula | C17H17BrOS |
| Exact Mass | 348.018349 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8yKZfe6G1lh |
|---|---|
| Name | 4-[(p-Bromophenyl)thio]-2-butenyl p-tolyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.018349340 u |
| Formula | C17H17BrOS |
| InChI | InChI=1S/C17H17BrOS/c1-14-4-8-16(9-5-14)19-12-2-3-13-20-17-10-6-15(18)7-11-17/h2-11H,12-13H2,1H3 |
| InChIKey | VOAFFFSPOKYJMG-UHFFFAOYSA-N |
| Molecular Weight | 349.286 g/mol |
| SMILES | C=1C(=CC=C(C1)Br)SCC=CCOC=1C=CC(=CC1)C |