Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C16H5ClF15N3O/c17-7-8(34-6-4-2-1-3-5(6)33-7)35-9(36)10(18,19)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)32/h1-4H,(H,34,35,36)
SMILES	O=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1nc2ccccc2nc1Cl
InChI Key	MUJBJGJPXJYYLG-UHFFFAOYSA-N
Molecular Formula	C16H5ClF15N3O
Exact Mass	575.659 g/mol

Data and Resources

• 1H nuclear magnetic resonance spectroscopy (1H NMR)HTML
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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/MUJBJGJPXJYYLG-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/MUJBJGJPXJYYLG-UHFFFAOYSA-N/CHMO0000593
Version
Author	Jérôme Klein
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T05:24:07.253529
MetadataModified	2024-09-07T20:52:33.139543
MetadataPublished	2021-12-26
Related Molecule

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

Data-Source Molecule ID	Data-Source
162369942	PubChem
The data in this table is sourced from UniChem at EBI.