Dataset

fast-atom bombardment mass spectrometry (FABMS)

dataset for fast-atom bombardment mass spectrometry (FABMS)

Chemical Information

molecular Image
InChI InChI=1S/C18H15N5O/c24-18(15-9-5-2-6-10-15)23-13-16-12-22(20-17(16)19-21-23)11-14-7-3-1-4-8-14/h1-10,12H,11,13H2
SMILES O=C(N1N=Nc2c(C1)cn(n2)Cc1ccccc1)c1ccccc1
InChI Key WJOQJVSLWFMJNK-UHFFFAOYSA-N
Molecular Formula C18H15N5O
Exact Mass 317.345 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WJOQJVSLWFMJNK-UHFFFAOYSA-N/CHMO0000563
License URL
Source https://www.chemotion-repository.net/inchikey/WJOQJVSLWFMJNK-UHFFFAOYSA-N/CHMO0000563
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-07-11
Related Molecule
  • (6-benzyl-4H-pyrazolo[3,4-d]triazin-3-yl)-phenylmethanone
    • Field Value
    Measurement Technique fast-atom bombardment mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    155928571 PubChem
    The data in this table is sourced from UniChem at EBI.