ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007835
RECORD_TITLE: 1-METHYLINDOLE; 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$NAME: 1-METHYLINDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H9N
CH$EXACT_MASS: 131.07350
CH$SMILES: [H]c(c([H])1)n(C)c(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C9H9N/c1-10-7-6-8-4-2-3-5-9(8)10/h2-7H,1H3
CH$LINK: CAS 603-76-9
CH$LINK: INCHIKEY BLRHMMGNCXNXJL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3060534
AC$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: splash10-001i-3900000000-b7a7193e11f5381b0ea9
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  15 1.03 10
  27 1.03 10
  28 2.02 20
  38 1.54 15
  39 4.28 43
  50 3.23 32
  51 5.6 56
  63 5.62 56
  65.5 9.33 93
  77 11.35 114
  89 13.74 137
  90 9.67 97
  103 9.87 99
  104 2.04 20
  116 7.15 72
  130 74.59 746
  131 99.99 999
  132 9.33 93
//
