| SpectraBase Spectrum ID |
DgKjvwkt0H3 |
| Name |
4-acetamido-3-phenyl-5-isothiazolecarboxylic acid methyl ester |
| CAS Registry Number |
105689-20-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12N2O3S |
| InChI |
InChI=1S/C13H12N2O3S/c1-8(16)14-11-10(9-6-4-3-5-7-9)15-19-12(11)13(17)18-2/h3-7H,1-2H3,(H,14,16) |
| InChIKey |
YUHMGWZDNXKRAT-UHFFFAOYSA-N |
| Molecular Weight |
276.310 g/mol |
| SMILES |
N(c1c(snc1-c1ccccc1)C(=O)OC)C(=O)C |
| SPLASH |
splash10-001i-0090000000-630664d08d3fbad6d900 |
| Source of Spectrum |
Y-22-1500-7 |
| Synonyms |
4-acetamido-3-phenyl-isothiazole-5-carboxylic acid methyl ester
methyl 4-acetamido-3-phenyl-1,2-thiazole-5-carboxylate
methyl 4-acetamido-3-phenyl-isothiazole-5-carboxylate |
| Wiley ID |
1279735 |
