ACCESSION: MSBNK-EPA-ENTACT_AGILENT001800
RECORD_TITLE: 1-Piperazineethanol; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 1-Piperazineethanol
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄N₂O
CH$EXACT_MASS: 130.1106130837
CH$SMILES: OCCN1CCNCC1
CH$IUPAC: InChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2
CH$LINK: CAS 103-76-4
CH$LINK: INCHIKEY WFCSWCVEJLETKA-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7677

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$FOCUSED_ION: PRECURSOR_M/Z 131.1178895354
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-001u-9200000000-f421184520c12905ee1a
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  41.038577 3.693001 36
  42.033826 15.963581 159
  43.054227 5.057812 50
  44.049476 53.928319 538
  45.033491 25.908998 258
  45.057301 2.190642 21
  56.049476 27.795655 277
  57.057301 2.252716 22
  58.065126 12.340436 123
  61.007276 1.766843 17
  63.994366 4.942644 49
  68.049476 2.42366 24
  70.065126 58.724088 586
  71.072951 2.635179 26
  72.080776 3.255425 32
  74.06004 3.731866 37
  79.017841 12.097316 120
  83.060375 1.23398 12
  84.0682 9.927571 99
  84.080776 23.618399 235
  85.076025 8.178993 81
  86.08385 1.52441 15
  87.091675 7.754221 77
  88.07569 76.874251 767
  88.112076 2.381796 23
  89.083515 3.586194 35
  98.08385 2.497771 24
  99.091675 6.139084 61
  100.07569 3.131193 31
  113.107325 7.365139 73
  129.102239 10.96288 109
  131.11789 99.999997 999
//