Dataset

fast-atom bombardment mass spectrometry (FABMS)

dataset for fast-atom bombardment mass spectrometry (FABMS)

Chemical Info

molecular Image
InChI InChI=1S/C36H28OP2.C12H11N2S.Cu/c1-5-17-29(18-6-1)38(30-19-7-2-8-20-30)35-27-15-13-25-33(35)37-34-26-14-16-28-36(34)39(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-15-12-6-4-10(5-7-12)14-9-11-3-2-8-13-11;/h1-28H;2-9H,1H3;/q;-1;+1/b;14-9+;
SMILES c1ccc(cc1)P(c1ccccc1Oc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1.CSc1ccc(cc1)/N=C/c1cccn1[Cu]
InChI Key APOKKEJOTUSELA-WNLPKAFNSA-N
Molecular Formula C48H39CuN2OP2S
Exact Mass 817.395 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/APOKKEJOTUSELA-WNLPKAFNSA-N/CHMO0000563
License URL
Source https://www.chemotion-repository.net/inchikey/APOKKEJOTUSELA-WNLPKAFNSA-N/CHMO0000563
Version
Author Valentina Ferraro
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-04-17
Related Molecule
  • nfdi4chem-mol8633 (Unknown Molecule)
    • Field Value
    Measurement Technique fast-atom bombardment mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.