Dataset
infrared absorption spectroscopy (IR) (ethyl 2-[3-(5-ethoxycarbonyl-4-hydroxy-1,3-thiazol-2-yl)phenyl]-4-hydroxy-1,3-thiazole-5-carboxylate)
Chemical Info
InChI | InChI=1S/C18H16N2O6S2/c1-3-25-17(23)11-13(21)19-15(27-11)9-6-5-7-10(8-9)16-20-14(22)12(28-16)18(24)26-4-2/h5-8,21-22H,3-4H2,1-2H3 |
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SMILES | CCOC(=O)c1sc(-c2cccc(-c3nc(O)c(C(=O)OCC)s3)c2)nc1O |
InChI Key | VQNXTBFBRGTADB-UHFFFAOYSA-N |
Molecular Formula | C18H16N2O6S2 |
Exact Mass | 420.468 g/mol |
Data and Resources
Related Resources
This dataset related as IsPartOf to https://dx.doi.org/10.14272/VQNXTBFBRGTADB-UHFFFAOYSA-N.1
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-sa/4.0 |
Source | |
Version | |
Author | Spruner von Mertz, Franziska, Ritter, Uwe, Täuscher, Eric |
Maintainer | chemotion.net |
Language | en |
MetadataCreated | 2022-10-06T15:09:02.639478 |
MetadataModified | 2022-10-06T15:09:02.639484 |
MetadataPublished |
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Measurement Technique | |
Measurement Variables |