ACCESSION: MSBNK-EPA-ENTACT_AGILENT000423
RECORD_TITLE: 2,2'-[(4-Methylphenyl)imino]diethanol; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2,2'-[(4-Methylphenyl)imino]diethanol
CH$NAME: DTXSID0044650
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₇NO₂
CH$EXACT_MASS: 195.1259287943
CH$SMILES: CC1=CC=C(C=C1)N(CCO)CCO
CH$IUPAC: InChI=1S/C11H17NO2/c1-10-2-4-11(5-3-10)12(6-8-13)7-9-14/h2-5,13-14H,6-9H2,1H3
CH$LINK: CAS 3077-12-1
CH$LINK: INCHIKEY JUVSRZCUMWZBFK-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:76497

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$FOCUSED_ION: PRECURSOR_M/Z 196.133205246
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0089-0900000000-3b46ddeea7bf13d2c3ba
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  45.033491 9.106485 90
  79.017841 1.012295 10
  91.054227 5.52716 55
  93.069877 1.376011 13
  106.065126 1.739239 17
  107.072951 5.089032 50
  108.080776 4.999084 49
  117.069877 1.101882 11
  118.065126 3.971537 39
  119.072951 9.688378 96
  120.080776 100.000001 999
  132.080776 13.609518 135
  133.088601 28.683818 286
  134.096426 80.414996 803
  135.104251 1.426203 14
  145.088601 2.80194 27
  151.099165 27.397116 273
  152.10699 7.032619 70
  158.096426 1.006264 10
  160.112076 8.339375 83
  178.122641 27.781795 277
  196.133205 18.644902 186
//