This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.

Formula: C28H30Cl4N10Pd2


Canonical SMILES:
CCCCc1nnn(c1)c1cnc2c(n1)cccc2.CCCCc1nnn(c1)c1cnc2c(n1)cccc2.Cl[Pd]Cl.Cl[Pd]Cl
InChI:
InChI=1S/2C14H15N5.4ClH.2Pd/c2*1-2-3-6-11-10-19(18-17-11)14-9-15-12-7-4-5-8-13(12)16-14;;;;;;/h2*4-5,7-10H,2-3,6H2,1H3;4*1H;;/q;;;;;;2*+2/p-4
InChIKey:
GQJLHAYEUVUOSM-UHFFFAOYSA-J
Exact Mass:
Crosslinks:   


Published on 2024-07-04This work is licensed under a Creative Commons Attribution 4.0 International License.

 

mass spectrometry (MS) 
Author: Laura Holzhauer1

1. Institute of Biological and Chemical Systems - Functional Molecular Systems (IBCS-FMS), Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
MS (FAB, 3-NBA), m/z (%): 647 [L2PdCl]+ (1), 307 (36), 289 (16), 155 (29), 154 (100), 139 (14), 138 (35), 137 (68), 136 (67), 120 (11), 107 (18), 90 (10), 89 (17). HRMS (C28H30N1035Cl1106Pd1): calcd 647.1373, found 647.1372.
Datasets