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)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C21H48N10.2BrH.Cu/c1-25(2)19(26(3)4)22-13-16-31(17-14-23-20(27(5)6)28(7)8)18-15-24-21(29(9)10)30(11)12;;;/h13-18H2,1-12H3;2*1H;/q;;;+2/p-2
SMILES CN(C(=NCCN(CCN=C(N(C)C)N(C)C)CCN=C(N(C)C)N(C)C)N(C)C)C.[Cu+2].[Br-].[Br-]
InChI Key PIQUIJJCADCIDM-UHFFFAOYSA-L
Molecular Formula C21H48Br2CuN10
Exact Mass 664.027 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PIQUIJJCADCIDM-UHFFFAOYSA-L/CHMO0002541
License URL
Source https://www.chemotion-repository.net/inchikey/PIQUIJJCADCIDM-UHFFFAOYSA-L/CHMO0002541
Version
Author Alexander Hoffmann
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:59:03.466974
MetadataModified 2024-09-08T01:59:03.467011
MetadataPublished 2023-11-21
Field Value
Measurement Technique high-resolution electrospray ionisation time-of-flight mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
169422766 PubChem
The data in this table is sourced from UniChem at EBI.