Dataset

METHYL 2,3-DIPHENYL-1-PYRROLINE-4-CARBOXYLATE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP010267 contains the MS mass spectrum of METHYL 2,3-DIPHENYL-1-PYRROLINE-4-CARBOXYLATE with the InChIkey OCMNRGUEENYBHL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C18H17NO2/c1-21-18(20)15-12-19-17(14-10-6-3-7-11-14)16(15)13-8-4-2-5-9-13/h2-11,15-16H,12H2,1H3
SMILES COC(=O)C(C2)C(c(c3)cccc3)C(=N2)c(c1)cccc1
InChI Key OCMNRGUEENYBHL-UHFFFAOYSA-N
Molecular Formula C18H17NO2
Exact Mass 279.126 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-JP010267
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MetadataPublished 2016-01-19
Related Molecule
  • methyl 4,5-diphenyl-3,4-dihydro-2H-pyrrole-3-carboxylate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    12940310 pubchem
    DTXSID50513519 comptox
    The data in this table is sourced from UniChem at EBI.