ACCESSION: MSBNK-EPA-ENTACT_AGILENT000335
RECORD_TITLE: 2-(Pyridin-4-yl)ethanol; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-(Pyridin-4-yl)ethanol
CH$NAME: DTXSID4044953
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₉NO
CH$EXACT_MASS: 123.0684139168
CH$SMILES: OCCC1C=CN=CC=1
CH$IUPAC: InChI=1S/C7H9NO/c9-6-3-7-1-4-8-5-2-7/h1-2,4-5,9H,3,6H2
CH$LINK: CAS 5344-27-4
CH$LINK: INCHIKEY DWPYQDGDWBKJQL-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:72921

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$FOCUSED_ION: PRECURSOR_M/Z 124.0756903685
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-00kf-9000000000-b490dca145171a70f2fb
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  39.022927 6.841999 68
  40.030752 6.83924 68
  41.026001 5.478519 54
  41.038577 2.343149 23
  51.022927 18.433303 184
  52.030752 3.612445 36
  53.038577 5.847558 58
  54.033826 6.124326 61
  65.038577 37.477282 374
  66.046402 32.134188 321
  67.041651 45.898838 458
  77.038577 32.025353 319
  78.033826 16.114721 160
  79.041651 4.131601 41
  79.054227 4.534347 45
  80.049476 5.931978 59
  91.041651 1.046951 10
  92.049476 70.559434 704
  93.057301 99.999999 999
  94.065126 2.128531 21
  104.049476 1.857675 18
  106.065126 22.246057 222
//