ACCESSION: MSBNK-EPA-ENTACT_AGILENT001074
RECORD_TITLE: 2-Ethyl-4-methyl-1H-imidazole; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-Ethyl-4-methyl-1H-imidazole
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₀N₂
CH$EXACT_MASS: 110.0843983338
CH$SMILES: CC1=CNC(CC)=N1
CH$IUPAC: InChI=1S/C6H10N2/c1-3-6-7-4-5(2)8-6/h4H,3H2,1-2H3,(H,7,8)
CH$LINK: CAS 931-36-2
CH$LINK: INCHIKEY ULKLGIFJWFIQFF-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:70262

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 111.0916747855
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-08fs-9400000000-a1fe4170eadbb5a5e13b
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  42.033826 1.344239 13
  55.041651 1.172503 11
  56.049476 72.155056 720
  57.057301 1.862531 18
  81.044725 7.852444 78
  83.060375 21.386424 213
  95.060375 4.330679 43
  96.0682 96.033123 959
  111.091675 99.999998 999
//