Dataset

high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)

dataset for high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)

Chemical Information

molecular Image
InChI InChI=1S/C20H30N6.2ClH.Fe/c1-23(2)19(24(3)4)21-16-13-9-11-15-12-10-14-17(18(15)16)22-20(25(5)6)26(7)8;;;/h9-14H,1-8H3;2*1H;/q;;;+2/p-2
SMILES CN(C(=Nc1cccc2c1c(ccc2)N=C(N(C)C)N(C)C)N(C)C)C.Cl[Fe]Cl
InChI Key QUQGCQVELVOFJG-UHFFFAOYSA-L
Molecular Formula C20H30Cl2FeN6
Exact Mass 481.243 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QUQGCQVELVOFJG-UHFFFAOYSA-L/CHMO0002541
License URL
Source https://www.chemotion-repository.net/inchikey/QUQGCQVELVOFJG-UHFFFAOYSA-L/CHMO0002541
Version
Author Sonja Herres-Pawlis
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-09-18
Related Molecule
  • 2-[8-[bis(dimethylamino)methylideneamino]naphthalen-1-yl]-1,1,3,3-tetramethylguanidine;dichloroiron
    • Field Value
    Measurement Technique high-resolution electrospray ionisation time-of-flight mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    168499159 PubChem
    The data in this table is sourced from UniChem at EBI.