Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C18H22F7N3O2/c1-6-30-15(29)12-7-8-14(26-27-28(10(2)3)11(4)5)13(9-12)16(19,20)17(21,22)18(23,24)25/h7-11H,6H2,1-5H3/b27-26+
SMILES	CCOC(=O)c1ccc(c(c1)C(C(C(F)(F)F)(F)F)(F)F)/N=N/N(C(C)C)C(C)C
InChI Key	HUEZGJSQUAALDK-CYYJNZCTSA-N
Molecular Formula	C18H22F7N3O2
Exact Mass	445.375 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/HUEZGJSQUAALDK-CYYJNZCTSA-N/NMR/1H/CDCl3/400
License URL
Source	https://www.chemotion-repository.net/inchikey/HUEZGJSQUAALDK-CYYJNZCTSA-N/NMR/1H/CDCl3/400
Version
Author	Andreas Hafner
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T23:41:43.163372
MetadataModified	2024-09-07T12:58:47.022924
MetadataPublished	2014-05-27

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables

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