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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000268

3-Methoxypropylamine; 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_AGILENT000268
RECORD_TITLE: 3-Methoxypropylamine; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3-Methoxypropylamine
CH$NAME: DTXSID7027596
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H11NO
CH$EXACT_MASS: 89.0840639806
CH$SMILES: COCCCN
CH$IUPAC: InChI=1S/C4H11NO/c1-6-4-2-3-5/h2-5H2,1H3
CH$LINK: CAS 5332-73-0
CH$LINK: INCHIKEY FAXDZWQIWUSWJH-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:1672

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$FOCUSED_ION: PRECURSOR_M/Z 90.0913404323
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-052b-9000000000-fdea0cccc260f3be4c56
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  30.033826 11.785737 117
  39.022927 3.230634 32
  41.038577 39.209032 391
  43.041651 8.423903 84
  44.049476 2.073576 20
  45.033491 99.999996 999
  45.057301 1.718432 17
  58.065126 87.315595 872
  73.064791 4.677802 46
//

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