ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004402
RECORD_TITLE: 7-CHLORO-2,5-DIMETHYL-1,2,3,4-TETRAHYDROPYRIMIDO(1,6-A)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$NAME: 7-CHLORO-2,5-DIMETHYL-1,2,3,4-TETRAHYDROPYRIMIDO(1,6-A)INDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H15ClN2
CH$EXACT_MASS: 234.09238
CH$SMILES: CN(C3)Cn(c(C3)1)c(c2)c(cc(Cl)c2)c(C)1
CH$IUPAC: InChI=1S/C13H15ClN2/c1-9-11-7-10(14)3-4-13(11)16-8-15(2)6-5-12(9)16/h3-4,7H,5-6,8H2,1-2H3
CH$LINK: INCHIKEY IRZSWPJYGDXTIV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40176617
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$SPLASH: splash10-0006-0920000000-28cc329e9e591bff54b9
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  77 1.2 12
  115 1.1 11
  127 1.3 13
  128 0.14 1
  129 1.1 11
  130 2.1 21
  143 1 10
  154 0.22 2
  155 1.3 13
  156 21.3 213
  164 2.1 21
  178 0.2 2
  190 10.7 107
  191 99.99 999
  192 12.1 121
  193 2.66 27
  233 1.2 12
  234 36.9 369
  235 3 30
  236 7.7 77
//
