| SpectraBase Spectrum ID |
DxQ95bGNLCw |
| Name |
1-[4'-(Hydroxycarbonyl)benzyl]-5-formyl-2-(methylthio)-imidazole |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12N2O3S |
| InChI |
InChI=1S/C13H12N2O3S/c1-19-13-14-6-11(8-16)15(13)7-9-2-4-10(5-3-9)12(17)18/h2-6,8H,7H2,1H3,(H,17,18) |
| InChIKey |
NFUFZTONVGJSES-UHFFFAOYSA-N |
| Molecular Weight |
276.310 g/mol |
| SMILES |
OC(c1ccc(C[n]2c(ncc2C=O)SC)cc1)=O |
| SPLASH |
splash10-002s-9310000000-ecf01fcb1d628d51bf7a |
| Source of Spectrum |
Y-39-371-3 |
| Synonyms |
4-{[5-formyl-2-(methylsulfanyl)-1H-imidazol-1-yl]methyl}benzoic acid
4-[[5-formyl-2-(methylthio)-1-imidazolyl]methyl]benzoic acid
4-[(5-formyl-2-methylsulfanylimidazol-1-yl)methyl]benzoic acid
4-[(5-formyl-2-methylsulfanyl-imidazol-1-yl)methyl]benzoic acid
4-[(5-methanoyl-2-methylsulfanyl-imidazol-1-yl)methyl]benzoic acid |
| Wiley ID |
1528456 |
![1-[4'-(Hydroxycarbonyl)benzyl]-5-formyl-2-(methylthio)-imidazole](/api/spectrum/DxQ95bGNLCw/structure.png?h=300&w=458 "1-[4'-(Hydroxycarbonyl)benzyl]-5-formyl-2-(methylthio)-imidazole")
