Dataset
infrared absorption spectroscopy (IR)
Chemical Info
InChI | InChI=1S/C13H20OS2/c1-8(2)12-9-3-4-10(11(14)7-9)13(12)15-5-6-16-13/h8-10,12H,3-7H2,1-2H3 |
---|---|
SMILES | CC(C1C2CCC(C31SCCS3)C(=O)C2)C |
InChI Key | FVNCCYVOXYDKDC-UHFFFAOYSA-N |
Molecular Formula | C13H20OS2 |
Exact Mass | 256.427 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/FVNCCYVOXYDKDC-UHFFFAOYSA-N/IR |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/FVNCCYVOXYDKDC-UHFFFAOYSA-N/IR |
Version | |
Author | Yu-Chieh Huang |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T01:27:18.077040 |
MetadataModified | 2024-09-07T15:38:03.422200 |
MetadataPublished | 2019-06-27 |
Related Molecule |
Field | Value |
---|---|
Measurement Technique | infrared absorption spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
No additional information available for this Dataset. |