ACCESSION: MSBNK-EPA-ENTACT_AGILENT001689
RECORD_TITLE: 2-Methylimidazole; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-Methylimidazole
CH$NAME: DTXSID4022107
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₆N₂
CH$EXACT_MASS: 82.0530982062
CH$SMILES: CC1NC=CN=1
CH$IUPAC: InChI=1S/C4H6N2/c1-4-5-2-3-6-4/h2-3H,1H3,(H,5,6)
CH$LINK: CAS 693-98-1
CH$LINK: INCHIKEY LXBGSDVWAMZHDD-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:12749

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$FOCUSED_ION: PRECURSOR_M/Z 83.0603746579
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0006-9000000000-295df8ae313fdf77a16b
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  40.018175 1.830453 18
  41.026001 23.748275 237
  42.021249 25.101674 250
  42.033826 99.999997 999
  43.041651 2.051571 20
  54.033826 1.506729 15
  56.049476 8.820319 88
  67.029075 6.34127 63
  68.0369 9.175492 91
  81.044725 1.253596 12
  83.060375 8.357506 83
//