Dataset
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Info
InChI | InChI=1S/C8H12OS/c9-10(7-1-2-7)8-3-6(4-8)5-8/h6-7H,1-5H2 |
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SMILES | O=S(C12CC(C1)C2)C1CC1 |
InChI Key | WKEMTKKUQMLXPX-UHFFFAOYSA-N |
Molecular Formula | C8H12OS |
Exact Mass | 156.245 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/WKEMTKKUQMLXPX-UHFFFAOYSA-N/CHMO0001146 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/WKEMTKKUQMLXPX-UHFFFAOYSA-N/CHMO0001146 |
Version | |
Author | Lukas Langer |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T01:38:18.500274 |
MetadataModified | 2024-09-08T01:38:18.500280 |
MetadataPublished | 2023-09-19 |
Field | Value |
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Measurement Technique | 1H–13C heteronuclear single quantum coherence |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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168499167 | PubChem |
The data in this table is sourced from UniChem at EBI. |