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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000999

4,4'-(Oxydiethylene)bis(morpholine); ESI-QTOF; MS2; CE: 20; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000999
RECORD_TITLE: 4,4'-(Oxydiethylene)bis(morpholine); ESI-QTOF; MS2; CE: 20; [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 20

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$SPLASH: splash10-03di-0900000000-f6ab45f46ff168dfd8dc
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  70.065126 2.7153 27
  84.080776 1.442768 14
  114.09134 100 999
  114.127726 4.831398 48
  114.140302 2.501416 24
  158.117555 16.740773 167
  245.185969 11.890456 118
//

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