ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004350
RECORD_TITLE: 3-(4-AMINO-4-METHYLPENTYL)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$NAME: 3-(4-AMINO-4-METHYLPENTYL)INDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H20N2
CH$EXACT_MASS: 216.16265
CH$SMILES: CC(C)(CCCC1=CNC2=CC=CC=C21)N
CH$IUPAC: InChI=1S/C14H20N2/c1-14(2,15)9-5-6-11-10-16-13-8-4-3-7-12(11)13/h3-4,7-8,10,16H,5-6,9,15H2,1-2H3
CH$LINK: INCHIKEY OQURMEDKJWNFCU-UHFFFAOYSA-N
AC$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-9410000000-256bf68f534069a13dd2
PK$NUM_PEAK: 51
PK$PEAK: m/z int. rel.int.
  27 1.6 16
  29 1.2 12
  30 3 30
  39 0.17 2
  41 1.9 19
  42 6.4 64
  43 2.6 26
  45 0.74 7
  51 1.5 15
  56 1.1 11
  57 1.3 13
  58 99.99 999
  59 4.1 41
  63 1.4 14
  70 1.4 14
  71 0.28 3
  73 3 30
  76 1.1 11
  77 4.5 45
  83.5 0.2 2
  84 6.4 64
  89 1.3 13
  91 1.2 12
  101 0.1 1
  102 1.8 18
  103 2.7 27
  115 2.6 26
  116 0.11 1
  117 1.7 17
  127 1.3 13
  128 2.2 22
  129 0.18 2
  130 9.6 96
  131 2.6 26
  139 1.2 12
  140 0.11 1
  142 1 10
  143 7.4 74
  144 2.4 24
  145 0.12 1
  154 3 30
  155 3 30
  157 1.6 16
  166 0.19 2
  167 8.6 86
  168 6.4 64
  169 3.1 31
  170 0.2 2
  171 2.3 23
  216 17.3 173
  217 2.6 26
//
