ACCESSION: MSBNK-EPA-ENTACT_AGILENT000216
RECORD_TITLE: Tetraethylenepentamine; ESI-QTOF; MS2; CE: 10; [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 10

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$SPLASH: splash10-0006-2900000000-5bf8f6532eff57766557
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  44.049476 6.723806 67
  70.065126 1.469843 14
  87.091675 40.560739 405
  104.118224 25.060857 250
  113.107325 19.340337 193
  130.133874 48.083311 480
  156.149524 1.844835 18
  173.176073 6.558551 65
  190.202622 99.999999 999
//