Dataset

fast-atom bombardment mass spectrometry (FABMS)

dataset for fast-atom bombardment mass spectrometry (FABMS)

Chemical Information

molecular Image
InChI InChI=1S/C21H24O/c1-21(2,3)20(22)19-14-17-9-8-15-4-6-16(7-5-15)10-12-18(19)13-11-17/h4-7,11,13-14H,8-10,12H2,1-3H3
SMILES O=C(C(C)(C)C)c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key TYCTXYVLCWMDDR-UHFFFAOYSA-N
Molecular Formula C21H24O
Exact Mass 292.415 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/TYCTXYVLCWMDDR-UHFFFAOYSA-N/CHMO0000563
License URL
Source https://www.chemotion-repository.net/inchikey/TYCTXYVLCWMDDR-UHFFFAOYSA-N/CHMO0000563
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-06-11
Related Molecule
  • 2,2-dimethyl-1-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)propan-1-one
    • Field Value
    Measurement Technique fast-atom bombardment mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    155921398 pubchem
    The data in this table is sourced from UniChem at EBI.