Dataset

FLEXIBILENE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP010843 contains the MS mass spectrum of FLEXIBILENE with the InChIkey SPMBDLTUBLYRCT-PWOPFSNCSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H32/c1-17-9-6-11-18(2)13-8-15-20(4,5)16-14-19(3)12-7-10-17/h8,10-11,14-15H,6-7,9,12-13,16H2,1-5H3/b15-8-,17-10+,18-11+,19-14-
SMILES CC(C1)=CCCC(C)=CCC(C)(C)C=CCC(C)=CC1
InChI Key SPMBDLTUBLYRCT-PWOPFSNCSA-N
Molecular Formula C20H32
Exact Mass 272.250 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP010843
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • (1E,4Z,8Z,12E)-2,6,6,9,13-pentamethylcyclopentadeca-1,4,8,12-tetraene
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    29356602 surechembl
    134767510 pubchem
    The data in this table is sourced from UniChem at EBI.