ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002004
RECORD_TITLE: 6-CHLORO-1,2,3,4-TETRAHYDRO-3-METHYL-GAMMA-CARBOLINE; 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$NAME: 6-CHLORO-1,2,3,4-TETRAHYDRO-3-METHYL-GAMMA-CARBOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₃ClN₂
CH$EXACT_MASS: 220.07673
CH$SMILES: CC1CC2=C(CN1)C3=C(N2)C(=CC=C3)Cl
CH$IUPAC: InChI=1S/C12H13ClN2/c1-7-5-11-9(6-14-7)8-3-2-4-10(13)12(8)15-11/h2-4,7,14-15H,5-6H2,1H3
CH$LINK: INCHIKEY AKTGQEFIXGTXKL-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$SPLASH: splash10-004i-0920000000-86577ad1321f8ca1156e
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  42 9.4 94
  44 2.3 23
  110 4 40
  115 0.66 7
  140 3.5 35
  141 5 50
  142 6.4 64
  143 0.75 8
  176 2.4 24
  177 99.99 999
  178 13.3 133
  179 3.08 31
  180 5.9 59
  217 2.9 29
  218 1.5 15
  219 1.25 13
  220 20 200
  221 5.9 59
  222 6.7 67
//