Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR) ()
Chemical Info
InChI | InChI=1S/C13H14N2O3S/c1-3-18-13-9(2)19-12(14-13)8-10-4-6-11(7-5-10)15(16)17/h4-9H,3H2,1-2H3/b12-8- |
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SMILES | CCOC1=N/C(=C/c2ccc([N+](=O)[O-])cc2)SC1C |
InChI Key | MKZKXVUZVQMBSS-WQLSENKSSA-N |
Molecular Formula | C13H14N2O3S |
Exact Mass | 278.333 g/mol |
Data and Resources
Related Resources
This dataset related as IsPartOf to https://dx.doi.org/10.14272/MKZKXVUZVQMBSS-WQLSENKSSA-N.1
Metadata Information
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Author | Zacher, Henrike, Täuscher, Eric |
Maintainer | chemotion-repository |
Language | en |
MetadataCreated | 2023-11-12T03:02:15.229095 |
MetadataModified | 2023-11-12T03:02:15.229099 |
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