SpectraBase Spectrum ID |
lrRkpapIiO |
Name |
Methyl 4-hydroxy-2,5,7-trimethyl-6-oxocyclohepa[d][1,3]thiazole-8-carboxylate |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H13NO4S |
InChI |
InChI=1S/C13H13NO4S/c1-5-8(13(17)18-4)12-9(14-7(3)19-12)11(16)6(2)10(5)15/h16H,1-4H3 |
InChIKey |
XKFQMCLMMWTHOX-UHFFFAOYSA-N |
Molecular Weight |
279.310 g/mol |
SMILES |
OC=1c2c(C(=C(C)C(C1C)=O)C(=O)OC)sc(n2)C |
SPLASH |
splash10-01ri-0090000000-a897e7d5348b606a8441 |
Source of Spectrum |
H1-51-1228-4 |
Synonyms |
Methyl 4-hydroxy-2,5,7-trimethyl-6-oxo-6H-cyclohepta[d][1,3]thiazole-8-carboxylate |
Wiley ID |
817123 |