Dataset
fast-atom bombardment mass spectrometry (FABMS)
Chemical Info
InChI | InChI=1S/C21H32N6O/c1-15(2)14-26-20(24-25-27(16(3)4)17(5)6)19(13-23-26)12-22-21(28)18-10-8-7-9-11-18/h7-11,13,15-17H,12,14H2,1-6H3,(H,22,28)/b25-24+ |
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SMILES | CC(Cn1ncc(c1/N=N/N(C(C)C)C(C)C)CNC(=O)c1ccccc1)C |
InChI Key | MPFTVRYGHBGKIC-OCOZRVBESA-N |
Molecular Formula | C21H32N6O |
Exact Mass | 384.518 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/MPFTVRYGHBGKIC-OCOZRVBESA-N/CHMO0000563 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/MPFTVRYGHBGKIC-OCOZRVBESA-N/CHMO0000563 |
Version | |
Author | Nicolai Wippert |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T04:44:38.585218 |
MetadataModified | 2024-09-07T20:01:40.845256 |
MetadataPublished | 2021-07-11 |
Field | Value |
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Measurement Technique | fast-atom bombardment mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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155928543 | PubChem |
The data in this table is sourced from UniChem at EBI. |