ACCESSION: MSBNK-EPA-ENTACT_AGILENT002332
RECORD_TITLE: 1-Methylimidazole; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 1-Methylimidazole
CH$NAME: DTXSID6052291
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₆N₂
CH$EXACT_MASS: 82.0530982062
CH$SMILES: CN1C=NC=C1
CH$IUPAC: InChI=1S/C4H6N2/c1-6-3-2-5-4-6/h2-4H,1H3
CH$LINK: CAS 616-47-7
CH$LINK: INCHIKEY MCTWTZJPVLRJOU-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:1390

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

PK$SPLASH: splash10-001l-9000000000-fe511d319bff6f4b2af8
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  41.026001 2.701777 26
  42.033826 55.705904 556
  43.041651 2.296692 22
  56.049476 17.714123 176
  67.029075 1.223437 12
  68.0369 11.667279 116
  83.060375 100.000002 999
//