ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004403
RECORD_TITLE: 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$NAME: 2,5-DIMETHYL-1,2,3,4-TETRAHYDROPYRIMIDO(1,6-A)INDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H16N2
CH$EXACT_MASS: 200.13135
CH$SMILES: CN(C3)Cn(c(C3)1)c(c2)c(ccc2)c(C)1
CH$IUPAC: InChI=1S/C13H16N2/c1-10-11-5-3-4-6-13(11)15-9-14(2)8-7-12(10)15/h3-6H,7-9H2,1-2H3
CH$LINK: INCHIKEY YUNDRVUPOZFFJE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID80176616
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$SPLASH: splash10-0a4i-0920000000-e759b5ab623aa448a9fa
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  55 1.2 12
  77 1.4 14
  115 2.2 22
  128 0.27 3
  130 3.8 38
  142 2.4 24
  144 3 30
  156 2.11 21
  157 99.99 999
  158 9.5 95
  199 1.4 14
  200 37.2 372
//
