Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C17H21F6N3O2/c1-6-28-15(27)11-7-12(16(18,19)20)14(13(8-11)17(21,22)23)24-25-26(9(2)3)10(4)5/h7-10H,6H2,1-5H3/b25-24+
SMILES CCOC(=O)c1cc(c(c(c1)C(F)(F)F)/N=N/N(C(C)C)C(C)C)C(F)(F)F
InChI Key CDVFKJVQQYBCLD-OCOZRVBESA-N
Molecular Formula C17H21F6N3O2
Exact Mass 413.358 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/CDVFKJVQQYBCLD-OCOZRVBESA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/CDVFKJVQQYBCLD-OCOZRVBESA-N/IR
Version
Author Andreas Hafner
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T00:03:17.578667
MetadataModified 2024-09-07T13:30:55.391992
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.