| SpectraBase Spectrum ID |
5BlWUHI26Bv |
| Name |
5-Methylthio-3-(4-(3,4-methylenedioxyphenyl)-1,3-butadienyl)pyrazole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H14N2O2S |
| InChI |
InChI=1S/C15H14N2O2S/c1-20-15-9-12(16-17-15)5-3-2-4-11-6-7-13-14(8-11)19-10-18-13/h2-9H,10H2,1H3,(H,16,17)/b4-2-,5-3- |
| InChIKey |
ZAEPACIOUTZRPJ-JVLMNHKTSA-N |
| Molecular Weight |
286.349 g/mol |
| SMILES |
[nH]1nc(cc1SC)\C=C/C=C\c1cc2OCOc2cc1 |
| SPLASH |
splash10-000i-0090000000-0671ff95836b6c2cd644 |
| Source of Spectrum |
Y-28-1347-8 |
| Synonyms |
3-[(1Z,3Z)-4-(1,3-benzodioxol-5-yl)-1,3-butadienyl]-1H-pyrazol-5-yl methyl sulfide
3-[(1Z,3Z)-4-(1,3-benzodioxol-5-yl)-1,3-butadienyl]-5-(methylsulfanyl)-1H-pyrazole
5-Methylthio-3-[4'-(3'',4''-methylenedioxyphenyl)-1',3'-butadienyl]pyrazole |
| Wiley ID |
1289688 |
