infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/AJGNXKNGUYYEFE-UHFFFAOYSA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
InChI | InChI=1S/C13H18O3S2/c1-16-12(15)11(13-17-6-3-7-18-13)9-4-2-5-10(14)8-9/h9H,2-8H2,1H3 |
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SMILES | COC(=O)C(=C1SCCCS1)C1CCCC(=O)C1 |
InChI Key | AJGNXKNGUYYEFE-UHFFFAOYSA-N |
Molecular Formula | C13H18O3S2 |
Exact Mass | 286.410 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 | a9330247-b831-4af6-abb3-f652d911dd4d |
Package id | 10-14272-ajgnxknguyyefe-uhfffaoysa-n-ir |
Resource type | HTML |
State | active |