MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004386

5-METHYL-1,2,3,4-TETRAHYDRO(2-2H1)PYRIMIDO(1,6-A)INDOLE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004386
RECORD_TITLE: 5-METHYL-1,2,3,4-TETRAHYDRO(2-2H1)PYRIMIDO(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

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CH$NAME: 5-METHYL-1,2,3,4-TETRAHYDRO(2-2H1)PYRIMIDO(1,6-A)INDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₄N₂
CH$EXACT_MASS: 186.11570
CH$SMILES: [2H]N(C3)Cn(c(C3)1)c(c2)c(ccc2)c(C)1
CH$IUPAC: InChI=1S/C12H14N2/c1-9-10-4-2-3-5-12(10)14-8-13-7-6-11(9)14/h2-5,13H,6-8H2,1H3/i/hD
CH$LINK: INCHIKEY LLVSTJSKEUSCEP-DYCDLGHISA-N

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-052e-0900000000-0865486f75b8bc27ca9c
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  42 8.8 88
  77 8.1 81
  115 6.3 63
  128 0.72 7
  130 5 50
  143 8.7 87
  144 64.6 646
  145 99.99 999
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  156 10 100
  157 56.3 563
  158 0.91 9
  159 24.4 244
  187 53.5 535
  188 7 70
//