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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000998

4,4'-(Oxydiethylene)bis(morpholine); ESI-QTOF; MS2; CE: 40; [M+H]+

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000998
RECORD_TITLE: 4,4'-(Oxydiethylene)bis(morpholine); ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 4,4'-(Oxydiethylene)bis(morpholine)
CH$NAME: DTXSID9042170
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H24N2O3
CH$EXACT_MASS: 244.1786926473
CH$SMILES: C1COCCN1CCOCCN1CCOCC1
CH$IUPAC: InChI=1S/C12H24N2O3/c1-7-15-8-2-13(1)5-11-17-12-6-14-3-9-16-10-4-14/h1-12H2
CH$LINK: CAS 6425-39-4
CH$LINK: INCHIKEY ZMSQJSMSLXVTKN-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:80900

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40

MS$FOCUSED_ION: PRECURSOR_M/Z 245.185969099
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-03k9-9400000000-3455e8961e67fe79ffd0
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  41.038577 8.151796 81
  42.033826 45.075552 450
  43.054227 5.663754 56
  44.049476 1.434001 14
  45.033491 7.682961 76
  56.049476 4.78945 47
  58.065126 5.083967 50
  68.049476 4.928338 49
  70.065126 86.434027 863
  70.098831 3.363277 33
  70.110065 1.752937 17
  84.080776 23.852197 238
  86.096426 7.829806 78
  114.09134 99.999995 999
  114.127726 4.879734 48
  158.117555 7.449642 74
//

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