ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006633
RECORD_TITLE: 5-METHOXY-2,3-DIMETHYL-1-(2-(6-METHYL-3-PYRIDYL)ETHYL)INDOLE; 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$NAME: 5-METHOXY-2,3-DIMETHYL-1-(2-(6-METHYL-3-PYRIDYL)ETHYL)INDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₉H₂₂N₂O
CH$EXACT_MASS: 294.17321
CH$SMILES: COc(c3)cc(c(C)1)c(c3)n(CCc(c2)cnc(C)c2)c(C)1
CH$IUPAC: InChI=1S/C19H22N2O/c1-13-5-6-16(12-20-13)9-10-21-15(3)14(2)18-11-17(22-4)7-8-19(18)21/h5-8,11-12H,9-10H2,1-4H3
CH$LINK: INCHIKEY MDKKFKKJFZJXBE-UHFFFAOYSA-N

AC$INSTRUMENT: JEOL JMS-01-SG-2
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-000i-0910000000-a46a352af8bc886237b6
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  57 1.2 12
  105 1.1 11
  106 2.1 21
  128 0.1 1
  130 1 10
  144 1.3 13
  145 15 150
  173 0.27 3
  188 99.99 999
  189 10 100
  294 25.6 256
//