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MassBank Record: MSBNK-EPA-ENTACT_AGILENT001398

N,N,N?,N?-Tetrakis(2-hydroxypropyl)ethylenediamine; ESI-QTOF; MS2; CE: 10; [M-H]-

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT001398
RECORD_TITLE: N,N,N?,N?-Tetrakis(2-hydroxypropyl)ethylenediamine; ESI-QTOF; MS2; CE: 10; [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 10

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$SPLASH: splash10-0006-2690000000-f1658eae7b5822852ab1
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  43.018938 25.491275 254
  57.034588 3.116556 31
  70.066223 2.837585 28
  82.066223 2.182029 21
  96.081873 2.067934 20
  114.092438 19.671993 196
  130.087352 3.850558 38
  132.103002 24.242634 242
  140.108088 4.089974 40
  158.094843 1.373185 13
  158.118652 50.947416 508
  247.202716 1.042235 10
  255.207802 7.256469 72
  273.218366 37.155711 371
  289.213281 2.8328 28
  291.228931 100.000006 999
//

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