ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004393
RECORD_TITLE: 7-METHOXY-1,2,3-TRIMETHYLINDOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: 7-METHOXY-1,2,3-TRIMETHYLINDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H15NO
CH$EXACT_MASS: 189.11536
CH$SMILES: COc(c2)c(n(C)1)c(cc2)c(C)c(C)1
CH$IUPAC: InChI=1S/C12H15NO/c1-8-9(2)13(3)12-10(8)6-5-7-11(12)14-4/h5-7H,1-4H3
CH$LINK: INCHIKEY BGYNKFZIOWEOSF-UHFFFAOYSA-N
AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0079-0900000000-847324ab3dd51f696a39
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  45 3.1 31
  77 3.5 35
  91 3.8 38
  94 0.66 7
  119 4.7 47
  131 4 40
  146 11.7 117
  159 0.3 3
  173 3.1 31
  174 57.4 574
  175 10.6 106
  188 1.02 10
  189 99.99 999
  190 16.9 169
//
