ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005095
RECORD_TITLE: 2,4,4-TRIMETHYL-3,4-DIHYDROQUINOLINE; 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$NAME: 2,4,4-TRIMETHYL-3,4-DIHYDROQUINOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H15N
CH$EXACT_MASS: 173.12045
CH$SMILES: CC(=N1)CC(C)(C)c(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C12H15N/c1-9-8-12(2,3)10-6-4-5-7-11(10)13-9/h4-7H,8H2,1-3H3
CH$LINK: INCHIKEY MJETWKCGZXNUCV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID70344049
AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4i-3900000000-b5b448851d827031bfc7
PK$NUM_PEAK: 67
PK$PEAK: m/z int. rel.int.
  25 1.7 17
  26 2.3 23
  27 3.9 39
  29 0.35 4
  37 3.8 38
  38 5.5 55
  39 13.7 137
  40 0.25 3
  41 4 40
  50 2.3 23
  51 4.2 42
  52 0.15 2
  53 1.4 14
  57 2.4 24
  57.5 2 20
  58 7.22 72
  59 3.1 31
  62.5 1.2 12
  63 1.5 15
  64 0.17 2
  64.5 1 10
  65 4.8 48
  65.5 1.9 19
  66 0.18 2
  71.5 2.2 22
  74 1.1 11
  75 2.5 25
  76 0.19 2
  77 1.9 19
  77.5 2.2 22
  78 1.9 19
  78.5 0.33 3
  79 4.2 42
  85.5 1.4 14
  90 3.1 31
  93 0.15 2
  101 1.7 17
  102 1.7 17
  103 1.6 16
  113 0.1 1
  114 1.5 15
  115 14.3 143
  116 6.3 63
  117 0.26 3
  118 2.3 23
  127 2.6 26
  128 5.3 53
  129 0.48 5
  130 5.1 51
  131 1.3 13
  140 2.8 28
  142 7.4 74
  143 5.9 59
  144 1.6 16
  149 0.19 2
  154 0.25 3
  155 1.8 18
  156 13.2 132
  157 66.6 666
  158 99.99 999
  159 12.1 121
  160 2.9 29
  170 1 10
  171 0.14 1
  172 1.4 14
  173 6.5 65
  174 1.7 17
//
