| SpectraBase Spectrum ID |
4bP5LqfeyWC |
| Name |
(2Z)-2-[2-(Allyloxy)-5-bromobenzylidene]-1-benzothiophen-3(2H)-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
371.981963831 u |
| Formula |
C18H13BrO2S |
| InChI |
InChI=1S/C18H13BrO2S/c1-2-9-21-15-8-7-13(19)10-12(15)11-17-18(20)14-5-3-4-6-16(14)22-17/h2-8,10-11H,1,9H2/b17-11- |
| InChIKey |
KWNHQMMCWWMHRR-BOPFTXTBSA-N |
| Molecular Weight |
373.264 g/mol |
| SMILES |
C=12S\C(C(C1C=CC=C2)=O)=C\C=1C(=CC=C(C1)Br)OCC=C |
![(2Z)-2-[2-(allyloxy)-5-bromobenzylidene]-1-benzothiophen-3(2H)-one](/api/spectrum/4bP5LqfeyWC/structure.png?h=300&w=458 "(2Z)-2-[2-(allyloxy)-5-bromobenzylidene]-1-benzothiophen-3(2H)-one")
