ACCESSION: MSBNK-EPA-ENTACT_AGILENT002411
RECORD_TITLE: N-Benzylethanolamine; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N-Benzylethanolamine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₃NO
CH$EXACT_MASS: 151.0997140444
CH$SMILES: OCCNCC1C=CC=CC=1
CH$IUPAC: InChI=1S/C9H13NO/c11-7-6-10-8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2
CH$LINK: CAS 104-63-2
CH$LINK: INCHIKEY XNIOWJUQPMKCIJ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:4348

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$FOCUSED_ION: PRECURSOR_M/Z 152.1069904961
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-00kf-9000000000-473a1c5eaadcf1d2f1fd
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  39.022927 6.873984 68
  41.038577 8.120142 81
  51.022927 2.5891 25
  63.022927 4.236461 42
  65.038577 74.340157 742
  65.083515 1.356048 13
  91.054227 100.000005 999
//