Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C6H12OS2/c1-5(7)6-8-3-2-4-9-6/h5-7H,2-4H2,1H3
SMILES CC(C1SCCCS1)O
InChI Key YPKVBMWYNZEMPS-UHFFFAOYSA-N
Molecular Formula C6H12OS2
Exact Mass 164.289 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YPKVBMWYNZEMPS-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/YPKVBMWYNZEMPS-UHFFFAOYSA-N/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:18:48.975915
MetadataModified 2024-09-07T15:25:23.283202
MetadataPublished 2019-06-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables