Dataset
high resolution fast-atom bombardment mass spectrometry (HRFABMS)
Chemical Info
InChI | InChI=1S/C18H18N4/c1-18(2,3)21-16-13-9-5-4-8-12(13)15-17(20-16)22-11-7-6-10-14(22)19-15/h4-11H,1-3H3,(H,20,21) |
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SMILES | CC(Nc1nc2c(c3c1cccc3)nc1n2cccc1)(C)C |
InChI Key | SFYOEOMJOCGUAE-UHFFFAOYSA-N |
Molecular Formula | C18H18N4 |
Exact Mass | 290.362 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/SFYOEOMJOCGUAE-UHFFFAOYSA-N/CHMO0000726 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/SFYOEOMJOCGUAE-UHFFFAOYSA-N/CHMO0000726 |
Version | |
Author | Mareen Stahlberger |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T08:20:15.665249 |
MetadataModified | 2024-09-08T00:18:40.978140 |
MetadataPublished | 2023-01-23 |
Field | Value |
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Measurement Technique | high resolution fast-atom bombardment mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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163197172 | PubChem |
The data in this table is sourced from UniChem at EBI. |