| SpectraBase Spectrum ID |
3RkxSN525wO |
| Name |
2-Bromanyl-4-[1-(4-methoxyphenyl)ethenyl]-1,3,5-trimethyl-benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
330.061928231 u |
| Formula |
C18H19BrO |
| InChI |
InChI=1S/C18H19BrO/c1-11-10-12(2)18(19)14(4)17(11)13(3)15-6-8-16(20-5)9-7-15/h6-10H,3H2,1-2,4-5H3 |
| InChIKey |
RDXAMJYFDSYJSW-UHFFFAOYSA-N |
| Molecular Weight |
331.253 g/mol |
| SMILES |
C=1(C(=C(Br)C(=CC1C)C)C)C(C=1C=CC(=CC1)OC)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864585 |
![2-Bromanyl-4-[1-(4-methoxyphenyl)ethenyl]-1,3,5-trimethyl-benzene](/api/spectrum/3RkxSN525wO/structure.png?h=300&w=458 "2-Bromanyl-4-[1-(4-methoxyphenyl)ethenyl]-1,3,5-trimethyl-benzene")
