Dataset
high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
Chemical Info
InChI | InChI=1S/C16H21N5.BrH.Cu/c1-19(2)14-8-9-17-15-12(14)6-5-7-13(15)18-16-20(3)10-11-21(16)4;;/h5-9H,10-11H2,1-4H3;1H;/q;;+1/p-1 |
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SMILES | CN1CCN(C1=Nc1cccc2c1nccc2N(C)C)C.[Cu+].[Br-] |
InChI Key | JUYDOVRGCDOKGG-UHFFFAOYSA-M |
Molecular Formula | C16H21BrCuN5 |
Exact Mass | 426.821 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/JUYDOVRGCDOKGG-UHFFFAOYSA-M/CHMO0002541 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/JUYDOVRGCDOKGG-UHFFFAOYSA-M/CHMO0002541 |
Version | |
Author | Alexander Hoffmann |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T07:04:33.003095 |
MetadataModified | 2024-09-07T22:38:58.091908 |
MetadataPublished | 2022-08-03 |
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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164889672 | PubChem |
The data in this table is sourced from UniChem at EBI. |