ACCESSION: MSBNK-EPA-ENTACT_AGILENT000230
RECORD_TITLE: 4-Hexyloxyaniline; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 4-Hexyloxyaniline
CH$NAME: DTXSID4022288
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₉NO
CH$EXACT_MASS: 193.1466642358
CH$SMILES: CCCCCCOC1C=CC(N)=CC=1
CH$IUPAC: InChI=1S/C12H19NO/c1-2-3-4-5-10-14-12-8-6-11(13)7-9-12/h6-9H,2-5,10,13H2,1H3
CH$LINK: CAS 39905-57-2
CH$LINK: INCHIKEY DJRKHTCUXRGYEU-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:38360

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$FOCUSED_ION: PRECURSOR_M/Z 194.1539406875
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-014i-9100000000-a9706cf233f2109c9b4c
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  39.022927 8.830263 88
  41.038577 7.240932 72
  42.033826 1.373596 13
  43.054227 7.409891 74
  55.054227 2.05158 20
  65.038577 100.000006 999
  65.083515 1.62899 16
  67.041651 4.124085 41
  67.054227 1.28338 12
  80.049476 6.211434 62
  81.057301 4.370419 43
  82.065126 5.189176 51
  92.049476 10.80415 107
  93.033491 23.899787 238
  93.057301 6.577315 65
  108.04439 2.084126 20
  109.052215 10.895091 108
  110.06004 14.488282 144
//