Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C13H13FN2O2S2/c1-18-12(17)11(13-19-7-2-8-20-13)16-15-10-5-3-9(14)4-6-10/h3-6H,2,7-8H2,1H3/b16-15+
SMILES	COC(=O)C(=C1SCCCS1)/N=N/c1ccc(cc1)F
InChI Key	AMXISWHLIUERHQ-FOCLMDBBSA-N
Molecular Formula	C13H13FN2O2S2
Exact Mass	312.383 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/AMXISWHLIUERHQ-FOCLMDBBSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/AMXISWHLIUERHQ-FOCLMDBBSA-N/IR
Version
Author	Bettina Stanek
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T22:45:52.339571
MetadataModified	2024-09-07T12:15:08.393269
MetadataPublished	2014-05-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.