Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C8H6F3NO4/c1-16-7-4-5(12(13,14)15)2-3-6(7)8(9,10)11/h2-4H,1H3
SMILES	COc1cc(ccc1C(F)(F)F)[N+](=O)(=O)[O-]
InChI Key	QUEVFDCCPXABJX-UHFFFAOYSA-N
Molecular Formula	C8H6F3NO4
Exact Mass	237.133 g/mol

Data and Resources

• infrared absorption spectroscopy (IR)HTML
  Explore

  • More information
  • Go to resource

• infrared-absorption...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/QUEVFDCCPXABJX-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/QUEVFDCCPXABJX-UHFFFAOYSA-N/IR
Version
Author	Andreas Hafner
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T23:36:40.794210
MetadataModified	2024-09-07T12:51:23.334700
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.