ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007828
RECORD_TITLE: 1,4-DIMETHYLINDOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: 1,4-DIMETHYLINDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H11N
CH$EXACT_MASS: 145.08915
CH$SMILES: Cc(c2)c(c([H])1)c(cc2)n(C)c([H])1
CH$IUPAC: InChI=1S/C10H11N/c1-8-4-3-5-10-9(8)6-7-11(10)2/h3-7H,1-2H3
CH$LINK: INCHIKEY YQYZZTOIMUEGDJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40343382
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0005-2900000000-111ef5225eb345158dc5
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  27 2.62 26
  28 1.04 10
  39 5.46 55
  42 2.73 27
  51 7.02 70
  58.5 3.01 30
  71.5 11.02 110
  72.5 10.52 105
  77 15.02 150
  78 3.51 35
  102 8.06 81
  103 11.55 116
  115 11.02 110
  116 3.48 35
  128 5.51 55
  130 9.02 90
  144 98.1 981
  145 99.99 999
  146 13.02 130
//
