| SpectraBase Spectrum ID |
5tgA0YlfiCV |
| Name |
5-[(1E,3E,5E)-6-(4-methoxyphenyl)hexa-1,3,5-trienyl]-3-(methylthio)-1H-pyrazole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H18N2OS |
| InChI |
InChI=1S/C17H18N2OS/c1-20-16-11-9-14(10-12-16)7-5-3-4-6-8-15-13-17(21-2)19-18-15/h3-13H,1-2H3,(H,18,19)/b4-3+,7-5+,8-6+ |
| InChIKey |
AIGLMLIMNCKTJM-OKWWDJPNSA-N |
| Molecular Weight |
298.404 g/mol |
| SMILES |
[nH]1nc(cc1SC)\C=C\C=C\C=C\c1ccc(cc1)OC |
| SPLASH |
splash10-0002-0090000000-0f2846f59b3d7f30d8eb |
| Source of Spectrum |
Y-28-1347-8 |
| Synonyms |
5-[(1E,3E,5E)-6-(4-methoxyphenyl)hexa-1,3,5-trienyl]-3-methylsulfanyl-1H-pyrazole |
| Wiley ID |
1300981 |
![5-[(1E,3E,5E)-6-(4-methoxyphenyl)hexa-1,3,5-trienyl]-3-(methylthio)-1H-pyrazole](/api/spectrum/5tgA0YlfiCV/structure.png?h=300&w=458 "5-[(1E,3E,5E)-6-(4-methoxyphenyl)hexa-1,3,5-trienyl]-3-(methylthio)-1H-pyrazole")
