Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C21H20F3NO/c1-2-3-6-13-25-14-18(17-7-4-5-8-19(17)25)20(26)15-9-11-16(12-10-15)21(22,23)24/h4-5,7-12,14H,2-3,6,13H2,1H3
SMILES	CCCCCn1cc(c2c1cccc2)C(=O)c1ccc(cc1)C(F)(F)F
InChI Key	FARAZPVIFYGKMX-UHFFFAOYSA-N
Molecular Formula	C21H20F3NO
Exact Mass	359.385 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/FARAZPVIFYGKMX-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/FARAZPVIFYGKMX-UHFFFAOYSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:23:53.264261
MetadataModified	2024-09-07T15:32:48.666314
MetadataPublished	2019-06-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453637	PubChem
The data in this table is sourced from UniChem at EBI.