Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C36H28OP2.C17H13N5O.BF4.Cu/c1-5-17-29(18-6-1)38(30-19-7-2-8-20-30)35-27-15-13-25-33(35)37-34-26-14-16-28-36(34)39(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-23-13-8-6-12(7-9-13)16-11-22(21-20-16)17-10-18-14-4-2-3-5-15(14)19-17;2-1(3,4)5;/h1-28H;2-11H,1H3;;/q;;-1;+1
SMILES	c1ccc(cc1)P(c1ccccc1Oc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1.F[B-](F)(F)F.COc1ccc(cc1)c1nnn(c1)c1cnc2c(n1)cccc2.[Cu+]
InChI Key	YFLBBRXHYALVNJ-UHFFFAOYSA-N
Molecular Formula	C53H41BCuF4N5O2P2
Exact Mass	992.223 g/mol

Data and Resources

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Metadata Information

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• Measurement

Field	Value
DOI	10.14272/YFLBBRXHYALVNJ-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/YFLBBRXHYALVNJ-UHFFFAOYSA-N/CHMO0000593
Version
Author	Laura Holzhauer
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:03:21.666528
MetadataModified	2024-09-08T04:03:21.666533
MetadataPublished	2024-07-05

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