Dataset

electrospray ionisation quadrupole detection (ESI Q Trap)

Chemical Info

InChI	InChI=1S/C36H28OP2.C18H16N6.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(2)14-9-7-13(8-10-14)17-12-24(22-21-17)18-11-19-15-5-3-4-6-16(15)20-18;2-1(3,4)5;/h1-28H;3-12H,1-2H3;;/q;;-1;+1
SMILES	c1ccc(cc1)P(c1ccccc1Oc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1.F[B-](F)(F)F.CN(c1ccc(cc1)c1nnn(c1)c1cnc2c(n1)cccc2)C.[Cu+]
InChI Key	JCEBWPRFNZHARZ-UHFFFAOYSA-N
Molecular Formula	C54H44BCuF4N6OP2
Exact Mass	1005.265 g/mol

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/JCEBWPRFNZHARZ-UHFFFAOYSA-N/CHMO0002337
License URL
Source	https://www.chemotion-repository.net/inchikey/JCEBWPRFNZHARZ-UHFFFAOYSA-N/CHMO0002337
Version
Author	Laura Holzhauer
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:03:39.733629
MetadataModified	2024-09-08T04:03:39.733634
MetadataPublished	2024-07-05

Field	Value
Measurement Technique	electrospray ionisation quadrupole detection
Measurement Variables

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