ACCESSION: MSBNK-EPA-ENTACT_AGILENT001147
RECORD_TITLE: Diallyldimethylammonium; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Diallyldimethylammonium
CH$NAME: DTXSID4027650
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₆N⁺
CH$EXACT_MASS: 126.1282745178
CH$SMILES: C[N+](C)(CC=C)CC=C
CH$IUPAC: InChI=1S/C8H16N/c1-5-7-9(3,4)8-6-2/h5-6H,1-2,7-8H2,3-4H3/q+1
CH$LINK: CAS 48042-45-1
CH$LINK: INCHIKEY YIOJGTBNHQAVBO-UHFFFAOYSA-N

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$FOCUSED_ION: PRECURSOR_M/Z 127.1355509695
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-005i-9500000000-8b2e756d07a98134e5e5
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  41.038577 2.796938 27
  42.033826 2.485468 24
  42.046402 1.646543 16
  58.065126 4.01187 40
  59.072951 2.354805 23
  70.065126 3.919282 39
  71.072951 2.624892 26
  84.080776 53.760395 537
  85.088601 83.504868 834
  86.096426 10.609119 105
  127.135551 99.999998 999
//