ACCESSION: MSBNK-EPA-ENTACT_AGILENT001394
RECORD_TITLE: N,N,N?,N?-Tetrakis(2-hydroxypropyl)ethylenediamine; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N,N,N?,N?-Tetrakis(2-hydroxypropyl)ethylenediamine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₃₂N₂O₄
CH$EXACT_MASS: 292.2362075248
CH$SMILES: CC(O)CN(CC(C)O)CCN(CC(C)O)CC(C)O
CH$IUPAC: InChI=1S/C14H32N2O4/c1-11(17)7-15(8-12(2)18)5-6-16(9-13(3)19)10-14(4)20/h11-14,17-20H,5-10H2,1-4H3
CH$LINK: CAS 102-60-3
CH$LINK: INCHIKEY NSOXQYCFHDMMGV-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7615

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20

MS$FOCUSED_ION: PRECURSOR_M/Z 291.2289310731
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-000x-9500000000-c6d0ef84967a6f5e7353
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  43.018938 99.999997 999
  43.042748 2.012253 20
  57.034588 12.730595 127
  68.050573 4.630103 46
  70.066223 8.940694 89
  82.066223 12.906386 128
  86.061137 1.680938 16
  88.076788 1.199177 11
  96.081873 5.174671 51
  98.061137 2.043949 20
  112.076788 2.218328 22
  114.092438 15.346973 153
  116.071702 2.933725 29
  130.087352 20.570378 205
  132.103002 22.208016 221
  140.108088 8.070457 80
  156.103002 1.915462 19
  158.118652 22.018342 219
  271.202716 1.058746 10
  289.213281 1.081083 10
  291.228931 1.878285 18
//