Dataset

N,N,N`,N`-Tetrakis(2-hydroxyethyl)hexanediamide; LC-ESI-QTOF; MS2; CE: RAMP 20-30 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU406406 contains the MS2 mass spectrum of N,N,N,N-Tetrakis(2-hydroxyethyl)hexanediamide with the InChIkey OKRNLSUTBJUVKA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H28N2O6/c17-9-5-15(6-10-18)13(21)3-1-2-4-14(22)16(7-11-19)8-12-20/h17-20H,1-12H2
SMILES C(CCC(=O)N(CCO)CCO)CC(=O)N(CCO)CCO
InChI Key OKRNLSUTBJUVKA-UHFFFAOYSA-N
Molecular Formula C14H28N2O6
Exact Mass 320.195 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU406406
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MetadataPublished 2015-12-28
Related Molecule
  • N,N,N',N'-tetrakis(2-hydroxyethyl)hexanediamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CB2142014 ChemicalBook
    ZINC000004538771 ZINC
    SCHEMBL132324 SureChEMBL
    7RNP0P8G1O FDA SRS
    36554092 eMolecules
    15915830 PubChem: Thomson Pharma
    6334-25-4 ACToR
    181642 ChEBI
    95283 PubChem
    DTXSID40212726 EPA CompTox Dashboard
    J1.064.409G Nikkaji
    The data in this table is sourced from UniChem at EBI.