ACCESSION: MSBNK-EPA-ENTACT_AGILENT000215
RECORD_TITLE: Tetraethylenepentamine; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Tetraethylenepentamine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₂₃N₅
CH$EXACT_MASS: 189.1953457707
CH$SMILES: NCCNCCNCCNCCN
CH$IUPAC: InChI=1S/C8H23N5/c9-1-3-11-5-7-13-8-6-12-4-2-10/h11-13H,1-10H2
CH$LINK: CAS 112-57-2
CH$LINK: INCHIKEY FAGUFWYHJQFNRV-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8197

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$FOCUSED_ION: PRECURSOR_M/Z 190.2026222224
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0006-9000000000-3e2fb07a39769f944776
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  41.038577 1.93577 19
  42.033826 7.173758 71
  43.054227 1.465668 14
  44.049476 99.999999 999
  56.049476 6.944788 69
  58.065126 1.965265 19
  70.065126 17.782858 177
  84.080776 2.300578 22
  87.091675 5.416602 54
//