Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C7H9NS/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,8H2,1H3 |
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SMILES | Cc1ccc(c(c1)S)N |
InChI Key | VUMZNLOQJGKGNE-UHFFFAOYSA-N |
Molecular Formula | C7H9NS |
Exact Mass | 139.218 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/VUMZNLOQJGKGNE-UHFFFAOYSA-N/CHMO0000595 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/VUMZNLOQJGKGNE-UHFFFAOYSA-N/CHMO0000595 |
Version | |
Author | Simone Gräßle |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T02:27:54.744430 |
MetadataModified | 2024-09-07T17:00:42.497264 |
MetadataPublished | 2020-02-28 |
Field | Value |
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Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |