fast-atom bombardment mass spectrometry (FABMS)
URL: https://www.chemotion-repository.net/inchikey/KOPNHBUFTQTRII-UHFFFAOYSA-N/CHMO0000563
Dataset description:
dataset for fast-atom bombardment mass spectrometry (FABMS)\n\n
Chemical Info
InChI | InChI=1S/C30H21N9O6/c31-37-34-25-22(28(40)43-16-19-10-4-1-5-11-19)26(35-38-32)24(30(42)45-18-21-14-8-3-9-15-21)27(36-39-33)23(25)29(41)44-17-20-12-6-2-7-13-20/h1-15H,16-18H2 |
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SMILES | O=C(c1c(N=[N+]=[N-])c(C(=O)OCc2ccccc2)c(c(c1N=[N+]=[N-])C(=O)OCc1ccccc1)N=[N+]=[N-])OCc1ccccc1 |
InChI Key | KOPNHBUFTQTRII-UHFFFAOYSA-N |
Molecular Formula | C30H21N9O6 |
Exact Mass | 603.544 g/mol |
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Additional Information
Field | Value |
---|---|
Data last updated | September 8, 2024 |
Metadata last updated | September 8, 2024 |
Created | September 8, 2024 |
Format | HTML |
License | No License Provided |
Id | 6652adf0-4987-4cc6-9481-599989f20464 |
Package id | 10-14272-kopnhbuftqtrii-uhfffaoysa-n-chmo0000563 |
Resource type | HTML |
State | active |