Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

Chemical Info

InChI	InChI=1S/C40H30F2N2P.BrH/c1-28-40(27-45(33-11-5-2-6-12-33,34-13-7-3-8-14-34)35-15-9-4-10-16-35)44-39-26-37(30-19-23-32(42)24-20-30)36(25-38(39)43-28)29-17-21-31(41)22-18-29;/h2-26H,27H2,1H3;1H/q+1;/p-1
SMILES	Fc1ccc(cc1)c1cc2nc(C[P+](c3ccccc3)(c3ccccc3)c3ccccc3)c(nc2cc1c1ccc(cc1)F)C.[Br-]
InChI Key	FCEQOJYQPIGYKL-UHFFFAOYSA-M
Molecular Formula	C40H30BrF2N2P
Exact Mass	687.554 g/mol

Data and Resources

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Metadata Information

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• Molecule Data-Sources

Field	Value
DOI	10.14272/FCEQOJYQPIGYKL-UHFFFAOYSA-M/CHMO0000597
License URL
Source	https://www.chemotion-repository.net/inchikey/FCEQOJYQPIGYKL-UHFFFAOYSA-M/CHMO0000597
Version
Author	Jérôme Klein
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T06:36:19.690279
MetadataModified	2024-09-07T22:12:05.233953
MetadataPublished	2022-04-17

Field	Value
Measurement Technique	19F nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
163197209	PubChem
The data in this table is sourced from UniChem at EBI.