Dataset

NPE_227.1543_9.6; LC-ESI-QFT; MS2; CE: 15-90; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag_Additional_Specs-ET110005 contains the MS2 mass spectrum of NPE_227.1543_9.6 with the InChIkey GDCVFNAQLOMGMS-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H18N2/c1-16-12-10-14(13-7-3-2-4-8-13)15-9-5-6-11-17-15/h2-9,11,14,16H,10,12H2,1H3
SMILES CNCCC(C1=CC=CC=C1)C1=NC=CC=C1
InChI Key GDCVFNAQLOMGMS-UHFFFAOYSA-N
Molecular Formula C15H18N2
Exact Mass 226.147 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag_Additional_Specs-ET110005
Version
Author
Maintainer
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MetadataPublished 2016-03-17
Related Molecule
  • N-methyl-3-phenyl-3-pyridin-2-ylpropan-1-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    14994408 PubChem: Thomson Pharma
    19428-44-5 ACToR
    161283 PubChem
    DTXSID60891491 EPA CompTox Dashboard
    J2.498.214I Nikkaji
    The data in this table is sourced from UniChem at EBI.