| SpectraBase Spectrum ID |
KNuiTwlm9Vj |
| Name |
4-[(p-Bromophenyl)thio]-2-butenyl p-tolyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| 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 |
| Spectrum/Structure Validation Score (Raman) |
0.816237 |
![4-[(p-Bromophenyl)thio]-2-butenyl p-tolyl ether](/api/spectrum/KNuiTwlm9Vj/structure.png?h=300&w=458 "4-[(p-Bromophenyl)thio]-2-butenyl p-tolyl ether")
