Dataset
high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
Chemical Info
InChI | InChI=1S/C19H28N6.2BrH.Cu/c1-23(2)19(24(3)4)22-13-14-25(15-17-9-5-7-11-20-17)16-18-10-6-8-12-21-18;;;/h5-12H,13-16H2,1-4H3;2*1H;/q;;;+2/p-2 |
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SMILES | CN(C(=NCCN(Cc1ccccn1)Cc1ccccn1)N(C)C)C.[Cu+2].[Br-].[Br-] |
InChI Key | XVFHQFWAYXFPTR-UHFFFAOYSA-L |
Molecular Formula | C19H28Br2CuN6 |
Exact Mass | 563.820 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/XVFHQFWAYXFPTR-UHFFFAOYSA-L/CHMO0002541 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/XVFHQFWAYXFPTR-UHFFFAOYSA-L/CHMO0002541 |
Version | |
Author | Alexander Hoffmann |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T01:59:09.365283 |
MetadataModified | 2024-09-08T01:59:09.365289 |
MetadataPublished | 2023-11-21 |
Field | Value |
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Measurement Technique | high-resolution electrospray ionisation time-of-flight mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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169422767 | PubChem |
The data in this table is sourced from UniChem at EBI. |