Dataset

2,3,5-TRIMETHYL-1,7-TRIMETHYLENEINDOLE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP004347 contains the MS mass spectrum of 2,3,5-TRIMETHYL-1,7-TRIMETHYLENEINDOLE with the InChIkey CYGAMRLWUSNXFC-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H17N/c1-9-7-12-5-4-6-15-11(3)10(2)13(8-9)14(12)15/h7-8H,4-6H2,1-3H3
SMILES Cc(c3)cc(c(C)1)c(c23)n(CCC2)c(C)1
InChI Key CYGAMRLWUSNXFC-UHFFFAOYSA-N
Molecular Formula C14H17N
Exact Mass 199.136 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-JP004347
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MetadataPublished 2016-01-19
Related Molecule
  • 2,3,6-trimethyl-1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraene
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    J45.385D Nikkaji
    608062 PubChem
    The data in this table is sourced from UniChem at EBI.