infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/OOWHPIJVOYHULD-UHFFFAOYSA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
InChI | InChI=1S/C13H22OS2/c1-4-5-6-12(9-10(2)14)11(3)13-15-7-8-16-13/h12H,4-9H2,1-3H3 |
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SMILES | CCCCC(C(=C1SCCS1)C)CC(=O)C |
InChI Key | OOWHPIJVOYHULD-UHFFFAOYSA-N |
Molecular Formula | C13H22OS2 |
Exact Mass | 258.443 g/mol |
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Additional Information
Field | Value |
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Data last updated | September 7, 2024 |
Metadata last updated | September 7, 2024 |
Created | September 7, 2024 |
Format | HTML |
License | No License Provided |
Id | 93a8a648-7473-427b-bd47-460bfa29bb1a |
Package id | 10-14272-oowhpijvoyhuld-uhfffaoysa-n-ir |
Resource type | HTML |
State | active |