Dataset

1-METHYLLYSERGIC ACID DIETHYLAMIDE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP003737 contains the MS mass spectrum of 1-METHYLLYSERGIC ACID DIETHYLAMIDE with the InChIkey VQZYKSWQIQANKB-DNVCBOLYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H27N3O/c1-5-24(6-2)21(25)15-10-17-16-8-7-9-18-20(16)14(12-22(18)3)11-19(17)23(4)13-15/h7-10,12,15,19H,5-6,11,13H2,1-4H3/t15-,19-/m1/s1
SMILES CCN(CC)C(=O)C([H])(C4)C([H])=C(c31)C([H])(N(C)4)Cc(c([H])2)c(c(ccc3)n(C)2)1
InChI Key VQZYKSWQIQANKB-DNVCBOLYSA-N
Molecular Formula C21H27N3O
Exact Mass 337.215 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-JP003737
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MetadataPublished 2016-01-19
Related Molecule
  • (6aR,9R)-N,N-diethyl-4,7-dimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    165200 PubChem
    DTXSID00895034 EPA CompTox Dashboard
    J15.145I Nikkaji
    4238-85-1 ACToR
    The data in this table is sourced from UniChem at EBI.