Dataset
high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
Chemical Info
InChI | InChI=1S/2C15H20N4.2BF4.Cu/c2*1-11-9-10-12-7-6-8-13(14(12)16-11)17-15(18(2)3)19(4)5;2*2-1(3,4)5;/h2*6-10H,1-5H3;;;/q;;2*-1;+2 |
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SMILES | F[B-](F)(F)F.F[B-](F)(F)F.Cc1ccc2c(n1)c(ccc2)N=C(N(C)C)N(C)C.Cc1ccc2c(n1)c(ccc2)N=C(N(C)C)N(C)C.[Cu+2] |
InChI Key | FNFSJYCLRPGNJN-UHFFFAOYSA-N |
Molecular Formula | C30H40B2CuF8N8 |
Exact Mass | 749.847 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/FNFSJYCLRPGNJN-UHFFFAOYSA-N/CHMO0002541 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/FNFSJYCLRPGNJN-UHFFFAOYSA-N/CHMO0002541 |
Version | |
Author | Alexander Hoffmann |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T06:20:25.897199 |
MetadataModified | 2024-09-07T21:59:08.960509 |
MetadataPublished | 2022-03-14 |
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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162677540 | PubChem |
The data in this table is sourced from UniChem at EBI. |