ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000435
RECORD_TITLE: 2-FORMYL-1-METHYLINDOLE; 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$NAME: 2-FORMYL-1-METHYLINDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H9NO
CH$EXACT_MASS: 159.06841
CH$SMILES: O=Cc(c1)n(C)c(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C10H9NO/c1-11-9(7-12)6-8-4-2-3-5-10(8)11/h2-7H,1H3
CH$LINK: INCHIKEY IBNGPIOSWCMJGG-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30295922
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$SPLASH: splash10-0a4i-5900000000-3f3ebfb3d3dbe7dab9fc
PK$NUM_PEAK: 64
PK$PEAK: m/z int. rel.int.
  39 5.5 55
  41 12.8 128
  42 2.8 28
  43 0.2 2
  44 2.2 22
  45 6.3 63
  50 1.3 13
  51 0.28 3
  54 1.3 13
  55 12.4 124
  56 3.5 35
  57 1.08 11
  60 8 80
  61 2.2 22
  62 2.4 24
  63 0.74 7
  64 1.3 13
  65 1.1 11
  67 2.4 24
  68 0.18 2
  69 11.1 111
  70 2.2 22
  71 4.8 48
  73 0.85 9
  74 1.3 13
  75 1.6 16
  76 1.3 13
  77 0.7 7
  78 1.1 11
  79 1.1 11
  81 3.7 37
  82 0.18 2
  83 4.6 46
  84 2.4 24
  85 3 30
  87 0.26 3
  88 2.2 22
  89 35.3 353
  90 3.3 33
  95 0.2 2
  96 1.5 15
  97 3.2 32
  98 1.8 18
  101 0.2 2
  102 3 30
  103 4.2 42
  104 1.1 11
  111 0.17 2
  114 1.5 15
  115 3.2 32
  116 5.1 51
  117 0.13 1
  128 3 30
  129 4.6 46
  130 27.8 278
  131 0.41 4
  144 11 110
  145 9.2 92
  149 2.8 28
  150 0.2 2
  157 2.8 28
  158 53 530
  159 99.99 999
  160 6.5 65
//
