Dataset

desorption electrospray ionisation mass spectrometry (DESIMS) ()

dataset for desorption electrospray ionisation mass spectrometry (DESIMS)

Chemical Info

molecular Image
InChI InChI=1S/2C40H24N8.8C10H14.4C6H4O4.2Au.10F5P.10FH.8Ru/c2*1-2-30-38(26-11-19-42-20-12-26)32-5-6-34(47-32)40(28-15-23-44-24-16-28)36-8-7-35(48-36)39(27-13-21-43-22-14-27)33-4-3-31(46-33)37(29(1)45-30)25-9-17-41-18-10-25;8*1-8(2)10-6-4-9(3)5-7-10;4*7-3-1-4(8)6(10)2-5(3)9;;;10*1-6(2,3,4)5;;;;;;;;;;;;;;;;;;/h2*1-24H;8*4-8H,1-3H3;4*1-2,7,10H;;;;;;;;;;;;;10*1H;;;;;;;;/q2*-2;;;;;;;;;;;;;2*+3;;;;;;;;;;;;;;;;;;;;;8*+2/p-18/b2*37-29-,37-31-,38-30-,38-32-,39-33-,39-35-,40-34-,40-36-;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
SMILES C1=Cc2nc1c(-c1ccncc1)c1ccc([n-]1)c(-c1ccncc1)c1nc(c(-c3ccncc3)c3ccc([n-]3)c2-c2ccncc2)C=C1.C1=Cc2nc1c(-c1ccncc1)c1ccc([n-]1)c(-c1ccncc1)c1nc(c(-c3ccncc3)c3ccc([n-]3)c2-c2ccncc2)C=C1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.FP(F)(F)(F)F.FP(F)(F)(F)F.FP(F)(F)(F)F.FP(F)(F)(F)F.FP(F)(F)(F)F.FP(F)(F)(F)F.FP(F)(F)(F)F.FP(F)(F)(F)F.FP(F)(F)(F)F.FP(F)(F)(F)F.O=C1C=C([O-])C(=O)C=C1[O-].O=C1C=C([O-])C(=O)C=C1[O-].O=C1C=C([O-])C(=O)C=C1[O-].O=C1C=C([O-])C(=O)C=C1[O-].[Au+3].[Au+3].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2]
InChI Key ZDABJYRHAPYMAL-AUSIHYDXSA-A
Molecular Formula C184H168Au2F60N16O16P10Ru8
Exact Mass 5511.578 g/mol

Data and Resources

Related Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source
Version
Author Moreno Alcántar, Luis Guillermo
Maintainer chemotion-repository
Language en
Measurement Technique IRI
MetadataCreated 2023-11-12T03:00:54.951335
MetadataModified 2023-11-12T03:00:54.951341
MetadataPublished
Field Value
Measurement Technique
Measurement Variables