ACCESSION: MSBNK-EPA-ENTACT_AGILENT000085
RECORD_TITLE: Dihexylamine; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Dihexylamine
CH$NAME: DTXSID1022009
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₇N
CH$EXACT_MASS: 185.2143498687
CH$SMILES: CCCCCCNCCCCCC
CH$IUPAC: InChI=1S/C12H27N/c1-3-5-7-9-11-13-12-10-8-6-4-2/h13H,3-12H2,1-2H3
CH$LINK: CAS 143-16-8
CH$LINK: INCHIKEY PXSXRABJBXYMFT-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8920

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 10

MS$FOCUSED_ION: PRECURSOR_M/Z 186.2216263204
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-000i-0900000000-f352fdf448e331415760
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  43.054227 5.741837 57
  57.069877 1.846245 18
  85.101177 1.405134 14
  102.127726 5.085763 50
  186.221626 100.000002 999
//